List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
292000 |
114004523 |
1 |
N4C13H30 |
A4B13C30 |
-16.4 |
3.73 |
-8.92 |
1.24 |
0 |
|
|
292001 |
114006056 |
1 |
N3O5C11H19 |
A3B5C11D19 |
-248.77 |
3.56 |
-9.9 |
0.24 |
0 |
|
|
292002 |
114007009 |
1 |
N3O3C11H19 |
A3B3C11D19 |
-85.39 |
2.81 |
-9.77 |
-0.52 |
0 |
|
|
292003 |
114007030 |
1 |
N3O4C10H19 |
A3B4C10D19 |
-112.81 |
1.5 |
-9.79 |
-0.6 |
0 |
|
|
292004 |
114007125 |
1 |
BrN2O4C11H13 |
AB2C4D11E13 |
-158.22 |
5.31 |
-9.48 |
-0.56 |
0 |
|
|
292005 |
114007367 |
1 |
N2O6C11H22 |
A2B6C11D22 |
-271.88 |
1.82 |
-9.19 |
0.34 |
0 |
|
|
292006 |
114007442 |
1 |
FN2O4C11H13 |
AB2C4D11E13 |
-192.66 |
1.95 |
-9.53 |
-0.3 |
0 |
|
|
292007 |
114007562 |
1 |
O4N5C9H15 |
A4B5C9D15 |
-130.79 |
6.87 |
-10.15 |
-0.71 |
0 |
|
|
292008 |
114007567 |
1 |
O4N5C10H15 |
A4B5C10D15 |
-116.45 |
6.24 |
-10.08 |
-0.14 |
0 |
|
|
292009 |
114007806 |
1 |
N3O4C12H23 |
A3B4C12D23 |
-197.88 |
2.9 |
-8.73 |
0.22 |
0 |
|
|
292010 |
114008772 |
1 |
BrINO2S2C11H17 |
ABCD2E2F11G17 |
-60.05 |
3.55 |
-9.75 |
-0.91 |
0 |
|
|
292011 |
114069544 |
1 |
BrOSN4C11H13 |
ABCD4E11F13 |
21.39 |
3.41 |
-8.98 |
-1.06 |
0 |
|
|
292012 |
114107723 |
1 |
ClN2O3C13H15 |
AB2C3D13E15 |
-29.2 |
4.64 |
-10.07 |
-1.66 |
0 |
|
|
292013 |
114112924 |
1 |
N2O3C12H22 |
A2B3C12D22 |
-121.95 |
5.71 |
-9.83 |
0.85 |
0 |
|
|
292014 |
114113884 |
1 |
BrSN2C14H19 |
ABC2D14E19 |
31.71 |
3.79 |
-8.42 |
-0.75 |
0 |
|
|
292015 |
114137359 |
1 |
SN2C14H26 |
AB2C14D26 |
-28.61 |
1.13 |
-8.87 |
0.03 |
0 |
|
|
292016 |
114137360 |
1 |
ClOSN3C13H14 |
ABCD3E13F14 |
2.41 |
3.53 |
-9.32 |
-1.03 |
0 |
|
|
292017 |
114137367 |
1 |
SN2C14H26 |
AB2C14D26 |
-30.93 |
0.97 |
-8.9 |
0.27 |
0 |
|
|
292018 |
114137373 |
1 |
BrSN4C13H13 |
ABC4D13E13 |
74.86 |
1.87 |
-8.66 |
-0.62 |
0 |
|
|
292019 |
114137379 |
1 |
ClOSN2C14H21 |
ABCD2E14F21 |
-56.09 |
2.32 |
-9.63 |
-0.84 |
0 |
|
|
292020 |
114137380 |
1 |
ClSN3C13H16 |
ABC3D13E16 |
31.46 |
5.61 |
-9.22 |
-0.52 |
0 |
|
|
292021 |
114143237 |
1 |
ClON5C11H18 |
ABC5D11E18 |
-42.04 |
1.92 |
-8.54 |
0.1 |
0 |
|
|
292022 |
114143912 |
1 |
O2N3C13H25 |
A2B3C13D25 |
-71.68 |
4.62 |
-9.16 |
0.78 |
0 |
|
|
292023 |
114144906 |
1 |
BrN2O2C12H17 |
AB2C2D12E17 |
-66.04 |
5.62 |
-9.61 |
-0.28 |
0 |
|
|
292024 |
114147414 |
1 |
ClNOC16H22 |
ABCD16E22 |
-73.33 |
1.59 |
-9.36 |
0.12 |
0 |
|
|
292025 |
114147448 |
1 |
BrNOC15H22 |
ABCD15E22 |
-68.72 |
5.47 |
-9.25 |
-0.03 |
0 |
|
|
292026 |
114147457 |
1 |
BrNOC16H22 |
ABCD16E22 |
-60.02 |
4.3 |
-9.18 |
-0.11 |
0 |
|
|
292027 |
114147509 |
1 |
BrNOC15H22 |
ABCD15E22 |
-74.51 |
5.03 |
-9.38 |
0.16 |
0 |
|
|
292028 |
114147575 |
1 |
NO2C14H21 |
AB2C14D21 |
-97.13 |
9.98 |
-8.79 |
0.38 |
0 |
|
|
292029 |
114147596 |
1 |
NO2C14H21 |
AB2C14D21 |
-83.15 |
2.95 |
-8.72 |
0.28 |
0 |
|
|
292030 |
114147626 |
1 |
ClNOC15H26 |
ABCD15E26 |
-97.49 |
5.37 |
-9.63 |
0.92 |
0 |
|
|
292031 |
114147650 |
1 |
ClNOC15H28 |
ABCD15E28 |
-118.73 |
5.38 |
-9.78 |
0.87 |
0 |
|
|
292032 |
114147665 |
1 |
ClNOBr2C14H16 |
ABCD2E14F16 |
-49.73 |
4.31 |
-10.12 |
-1.07 |
0 |
|
|
292033 |
114147884 |
1 |
ClNO2F3C12H19 |
ABC2D3E12F19 |
-294.21 |
3.85 |
-9.88 |
0.54 |
0 |
|
|
292034 |
114148112 |
2 |
ON2C6H10 |
AB2C6D10 |
-80.05 |
5.52 |
-9.15 |
0.47 |
0 |
|
|
292035 |
114148253 |
1 |
BrNS2O4C10H20 |
ABC2D4E10F20 |
-196.35 |
7.3 |
-10.56 |
-0.32 |
0 |
|
|
292036 |
114148322 |
1 |
N2O2C13H22 |
A2B2C13D22 |
-102.02 |
4.24 |
-10.2 |
0.59 |
0 |
|
|
292037 |
114148334 |
1 |
ClNSO2C14H20 |
ABCD2E14F20 |
-92.58 |
5.1 |
-9.72 |
-0.48 |
0 |
|
|
292038 |
114148337 |
1 |
ClSO2N3C12H20 |
ABC2D3E12F20 |
-95.82 |
7.29 |
-9.88 |
0.0 |
0 |
|
|
292039 |
114148349 |
1 |
BrNO2S2C12H18 |
ABC2D2E12F18 |
-79.53 |
6.45 |
-9.38 |
-0.78 |
0 |
|
|
292040 |
114148400 |
1 |
O2N3C13H27 |
A2B3C13D27 |
-87.77 |
3.42 |
-8.93 |
0.94 |
0 |
|
|
292041 |
114148497 |
1 |
NO4C14H21 |
AB4C14D21 |
-168.58 |
6.91 |
-9.69 |
-0.72 |
0 |
|
|
292042 |
114148557 |
1 |
SN2O4C11H16 |
AB2C4D11E16 |
-156.92 |
8.92 |
-9.63 |
-1.1 |
0 |
|
|
292043 |
114150074 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-78.47 |
2.73 |
-9.86 |
-0.58 |
0 |
|
|
292044 |
114150077 |
1 |
N2O3C12H24 |
A2B3C12D24 |
-164.75 |
2.44 |
-9.87 |
0.86 |
0 |
|
|
292045 |
114150089 |
1 |
N2O2C13H26 |
A2B2C13D26 |
-130.11 |
4.04 |
-9.11 |
1.06 |
0 |
|
|
292046 |
114150092 |
1 |
N2O2C13H26 |
A2B2C13D26 |
-126.7 |
6.45 |
-9.0 |
1.23 |
0 |
|
|
292047 |
114150119 |
1 |
N2O2C13H28 |
A2B2C13D28 |
-143.26 |
4.38 |
-9.46 |
1.0 |
0 |
|
|
292048 |
114150206 |
1 |
N3O3C12H19 |
A3B3C12D19 |
-106.55 |
2.73 |
-8.91 |
-0.96 |
0 |
|
|
292049 |
114152047 |
1 |
SN2O2C13H28 |
AB2C2D13E28 |
-137.53 |
2.32 |
-8.73 |
0.57 |
0 |