
Tell me about the atomic charges, dipole moment,
bond lengths,
angles,
bond orders,
molecular orbital energies,
or total energy.
Tell me about the best Lewis structure.
1. A bonding orbital for O1C2 with 1.9876 electrons
__has 66.78% O 1 character in a sp2.37 hybrid
__has 33.22% C 2 character in a s0.98 p3 hybrid
2. A bonding orbital for O1C2 with 1.9771 electrons
__has 81.36% O 1 character in a ppi orbital ( 99.82% p 0.18% d)
__has 18.64% C 2 character in a ppi orbital ( 98.79% p 1.21% d)
3. A bonding orbital for O1C7 with 1.9574 electrons
__has 73.50% O 1 character in a s0.26 p3 hybrid
__has 26.50% C 7 character in a s0.21 p3 hybrid
4. A bonding orbital for C2C3 with 1.9953 electrons
__has 53.76% C 2 character in a sp1.21 hybrid
__has 46.24% C 3 character in a sp2.86 hybrid
5. A bonding orbital for C2C7 with 1.9841 electrons
__has 50.67% C 2 character in a sp2.31 hybrid
__has 49.33% C 7 character in a sp2.57 hybrid
6. A bonding orbital for C3H4 with 1.9507 electrons
__has 63.88% C 3 character in a s0.93 p3 hybrid
__has 36.12% H 4 character in a s orbital
7. A bonding orbital for C3H5 with 1.9823 electrons
__has 63.95% C 3 character in a sp2.69 hybrid
__has 36.05% H 5 character in a s orbital
8. A bonding orbital for C3H6 with 1.9505 electrons
__has 63.87% C 3 character in a s0.92 p3 hybrid
__has 36.13% H 6 character in a s orbital
9. A bonding orbital for C7H8 with 1.9857 electrons
__has 63.01% C 7 character in a sp2.05 hybrid
__has 36.99% H 8 character in a s orbital
10. A bonding orbital for C7H9 with 1.9857 electrons
__has 63.01% C 7 character in a sp2.05 hybrid
__has 36.99% H 9 character in a s orbital
15. A lone pair orbital for O1 with 1.9881 electrons
__made from a sp0.59 hybrid
118. A antibonding orbital for O1C2 with 0.1020 electrons
__has 18.64% O 1 character in a ppi orbital ( 99.82% p 0.18% d)
__has 81.36% C 2 character in a ppi orbital ( 98.79% p 1.21% d)
With core pairs on: O 1 C 2 C 3 C 7 
The interaction of bonding donor orbital, 1, for O1C2 with the antibonding acceptor orbital, 119, for O1C7 is 25.3 kJ/mol.
The interaction of the second bonding donor orbital, 2, for O1C2 with the antibonding acceptor orbital, 125, for C7H8 is 26.8 kJ/mol.
The interaction of the second bonding donor orbital, 2, for O1C2 with the antibonding acceptor orbital, 126, for C7H9 is 26.8 kJ/mol.
The interaction of bonding donor orbital, 3, for O1C7 with the antibonding acceptor orbital, 117, for O1C2 is 48.8 kJ/mol.
The interaction of bonding donor orbital, 3, for O1C7 with the antibonding acceptor orbital, 120, for C2C3 is 100. kJ/mol.
The interaction of bonding donor orbital, 6, for C3H4 with the second antibonding acceptor orbital, 118, for O1C2 is 58.4 kJ/mol.
The interaction of bonding donor orbital, 7, for C3H5 with the antibonding acceptor orbital, 121, for C2C7 is 38.0 kJ/mol.
The interaction of bonding donor orbital, 8, for C3H6 with the second antibonding acceptor orbital, 118, for O1C2 is 58.8 kJ/mol.
19  3.819
18  4.085
17  7.918
16  9.765
15 ^v 15.09
14 ^v 15.42
13 ^v 16.26
12 ^v 16.57
11 ^v 17.94
10 ^v 18.94
9 ^v 19.42
8 ^v 20.69
7 ^v 24.25
6 ^v 25.60
5 ^v 35.60
4 ^v 273.0
3 ^v 275.1
2 ^v 276.8
1 ^v 515.7
Total electronic energy = 192.2603841669 Hartrees
^{*} The ketone isomer of this cation rearranges to give this cyclic isomer. This ion is the product of the decomposition of a methyl ketone radical cation, or heterolytic bond breaking of the stable neutral methyl ketone. The acyclic isomer is much higher in energy.