Ch342


02/06/2012: Wednesday

Handin homework:
General Chemistry Test, : Due date 02/15/2011.

Homework to hand in: Handin 1, : Due date 02/08/2011.
Reading: Shattuck- Foundations of Quantum Mechanics Ch. 23.1-23.3

02/08/2012: Friday

Read for Tuesday lab:
T1 Determination of beta-ionone.
Read for Tuesday lab: Atkins Ch18:18.1-18.5,18.7-18.11


02/11/2012: Monday

NMR periodic table,
Homework to hand in: Handin 2, Spectral Deconvolution Excel Example    Spectral Deconvolution: Bromothymol Blue : Due date 02/15/2012.

Check out the photos Erwin Schrodinger and Werner Heisenberg,

Reading: Claridge 2.1-2.5.2
Reading: Shattuck-Ch. 23.4-23.6
Homework (not to hand in): Shattuck-Ch. 23: 1,7,11,20,21,23

02/12/2012: Tuesday

An applet to calculate
Fourier transforms, (by Jeff Clymer)
Interactive NMR Frequency Map, (use Firefox)

02/13/2012: Wednesday

Homework (not to hand in): Shattuck-Ch. 23: 26-31,33,34,37,42,45

02/15/2012: Friday

Print off and bring to lab on Tuesday:
MOE Exercises, sections: Checklist for Molecular Mechanics Calculations and Chapts 9 & 10: Dynamics in Small Peptides
Scanning tunneling microscopy: Quantum Electron Corrals
Background reading for lab on NMR: Claridge 2.1-2.5.2, 5.1-5.4
Reading: Shattuck--Ch. 23.5-23.8

02/18/2013: Monday

Handin Homework:
Handin 3, : Due date 02/22/2013.


02/22/2013: Friday

Reading for Tuesday Lab:
NOESY Spectroscopy of beta-ionone, and Claridge: 8.1-8.3, 5.1-5.2
Handin Homework: Handin 4, but skip problem 4 for now : Due date 03/01/2013.


02/25/2013: Monday

Reading: Shattuck-Ch. 24.1-24.5 Vibration and Rotation

02/26/2013: Tuesday

Lab assignment:
Calculating NMR Chemical Shifts for beta-Ionone, : Due date Monday 03/11/2013.


02/27/2013: Wednesday

Reading: Chapter 24 all

03/01/2013: Friday

Homework (not to hand in): Chapter 24: 3,6,7,9,14,16,18,19,20,21,23

03/04/2013: Monday

Homework to handin:
Handin 4 (problem 4 only), Handin 5 (problem 1 only), : Due date 03/07/2013.

Reading: Chapter 25 sections 1-2 Hydrogen atom
Assign the chemical shifts in a terpene. Pick up your terpene (Monday or Tuesday)

03/05/2013: Tuesday

Possible terpenes for NMR experiment:
Terpenes,
COSY spectrum of Camphor,

03/06/2013: Wednesday

Review session: 7:00 p.m. Keyes102

03/07/2013: Thursday

Lab due Handin due

03/08/2013: Friday

Test: p.m. Chapters 23-24

03/11/2013: Monday

Homework to hand in:
Handin 5 questions 2-4, Handin 6 question 1 only, : Due date 03/15/2013.

Reading: Chapter 25:3-6,9(addendum)

03/15/2013: Friday

Reading for Tuesday"s lab: "X-ray Diffraction Studies of Powdered Crystals." in R. J. Sime, Physical Chemistry, Exp. 37. (see Library Reserves) Also, Atkins X-ray diffraction sections: Ch 23.1-3(d). Reading due date 03/19/2010
Homework (not to hand in): Ch. 25 (Atoms):5,7,9,10,12,14,17,20,21,23,25,27,28,29,32,36

03/18/2013: Monday

Homework to hand in:
Handin 6 (question 2 only), Handin 7, : Due date 04/02/2013.


03/20/2013: Wednesday

MOPAC instructions for Diatomics,
Running MOPAC on OS-X on Lab Macs: MOPAC script,
Reading: Shattuck Ch. 26 Sections 1-3 or Atkins Ch. 14 Sections 4-6

03/22/2013: Friday

Reading for Tuesday"s Lab:
Ozone Molecular Orbital Calculations, Reading : Due date 04/02/2013.

Handin due

04/01/2013: Monday

Homework to hand in:
Handin 8, : Due date 04/05/2013.


04/02/2013: Tuesday

Lab due

04/03/2013: Wednesday

Reading: Shattuck Ch. 26; Atkins Ch. 14
Homework (not to hand in): Atkins: Chapt 14. Exercises: 7a,7b,5a,6b,10b,11a,13a,13b,15b Problems: 2,4,8,14,19,21,22

04/05/2013: Friday

Reading for Lab on April 5: Sime, Rodney J , "Physical Chemistry: Methods, Techniques, and Experiments" Exp. 38, pp 738-741 and Exp. 40, pp 759-766 (you also might want to review Sime Exp. 37 pp. 725-733), which are all on electronic reserve. Reading : Due date 04/09/2013.

Homework due

04/09/2013: Tuesday

Lab due

04/05/2013: Friday

Homework due

04/10/2013: Wednesday

Chirped pulse- fourier transform microwave spectroscopy
CPFTMW,
Some help on visualizing space groups: Space Groups,
Some help on understanding strucutre factors (Fhkl): Structure factor applet,
Review session 8:30 p.m. Keyes 102

04/12/2013: Friday

Test p.m., Ch. 25,26 (skip, for now, section 26.5 on the Roothan equation and the description of DFT [Atkins 14.9])
For lab on Tuesday:
Vibrational-Rotational Spectroscopy of HCl and DCl,
Chirped pulse Fourier transform microwave spectroscopy and Radical raction dynamics,

04/15/2013: Monday

Homework to hand in:
Handin 10, (we may delay question 2 (only), check with me on Wednesday) : Due date 04/19/2013.

Reading Atkins Ch. 16.1-16.16

04/19/2013: Friday

Handin due

04/22/2013: Monday

Handin homework:
Handin 11, Do two (2) molecules for the first question. : Due date 04/26/2013.


04/24/2013: Wednesday

Reading: Atkins: 17.1-17.4, 17.8-17.10
Home work (not to hand in): Chapt 16. Exercises: 7a,8a,11a,15a,16a,19a,20a,22a,23a,26a Problems: 5,12,15,29

04/26/2013: Friday

Reading: Atkins Ch. 19.1-19.5; Shattuck Ch. 12
Home work (not to hand in): Chapt 17 Exercises: 8b,10a,16a Problems: 1,2,11,12,14,19,20,25,27

04/29/2013: Monday

Homework (not to hand in): Electronic Spectroscopy
Answers, (problems from the in-class handout on molecular term symbols for diatomics)

05/01/2013: Wednesday

Reading: Atkins Ch. 19, Ch. 20.1-20.2

05/03/2013: Friday

Homework (not to hand in): Chapt 19. Exercises: 6a,8a,10a,11b,15a Problems: 9,14,15,16,18,22
For lab on Tuesday:
Classical Trajectory Calculations, and Atkins Ch. 27.7-27.8: Reading : Due date 05/07/2013.


05/06/2013: Monday

Homework to hand in:
Handin 13, (Spreadsheet with constants), (E-mail your completed speadsheet) : Due date 05/10/2013.

Homework (not to hand in): Chapt 20. Exercises: 4a,6a,7a,12b,13a,17a Problem: 12 ; Chapt 21. Exercises: 2a,3a,10a,12b Problems: 5,6
Reading: Atkins 20.3, 20.6, 20.7

05/07/2013: Tuesday

Lab due

05/08/2013: Wednesday

Reading: Atkins: Ch. 27.4-27.8
Homework (not to hand in): Chapt 27. Exercises: 13a,14a,17a Problems: 15,21

05/10/2013: Friday

Handin due

Legend:
Homework to hand in, Homework to do, but not hand in.