List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
322834 |
126671288 |
1 |
NSO3C13H19 |
ABC3D13E19 |
-98.84 |
3.19 |
-8.69 |
-0.29 |
0 |
|
|
322835 |
126671303 |
1 |
ClS2O7N8C51H61 |
AB2C7D8E51F61 |
-196.79 |
14.29 |
-9.01 |
-1.53 |
0 |
|
|
322836 |
126671318 |
1 |
ClF2N2O3C20H25 |
AB2C2D3E20F25 |
-238.45 |
1.04 |
-9.7 |
-0.31 |
0 |
|
|
322837 |
126671319 |
1 |
SF3O8C20H35 |
AB3C8D20E35 |
-546.96 |
8.03 |
-9.92 |
-0.65 |
0 |
|
|
322838 |
126671320 |
1 |
N3O3C17H17 |
A3B3C17D17 |
-17.65 |
5.23 |
-9.05 |
-1.15 |
0 |
|
|
322839 |
126671361 |
1 |
ClS2O6N10C53H59 |
AB2C6D10E53F59 |
-109.57 |
10.4 |
-9.03 |
-1.53 |
0 |
|
|
322840 |
126671382 |
1 |
OSN4C22H24 |
ABC4D22E24 |
53.48 |
10.06 |
-9.08 |
-1.31 |
0 |
|
|
322841 |
126671384 |
1 |
S2N9O9C57H69 |
A2B9C9D57E69 |
-269.53 |
7.21 |
-8.63 |
-1.38 |
0 |
|
|
322842 |
126671444 |
1 |
NOC25H33 |
ABC25D33 |
-29.74 |
1.44 |
-8.61 |
0.16 |
0 |
|
|
322843 |
126671445 |
1 |
NO2C23H29 |
AB2C23D29 |
-53.19 |
2.23 |
-8.76 |
0.05 |
0 |
|
|
322844 |
126671446 |
1 |
ClS2O5N11C54H58 |
AB2C5D11E54F58 |
-25.4 |
10.12 |
-9.22 |
-1.42 |
0 |
|
|
322845 |
126671448 |
1 |
ON2C26H36 |
AB2C26D36 |
-20.43 |
2.17 |
-8.46 |
0.09 |
0 |
|
|
322846 |
126671450 |
1 |
IN2O2H11C19 |
AB2C2D11E19 |
72.24 |
1.57 |
-8.47 |
-2.86 |
0 |
|
|
322847 |
126671451 |
1 |
N2O3H16C23 |
A2B3C16D23 |
9.46 |
2.5 |
-8.88 |
-1.38 |
0 |
|
|
322848 |
126671452 |
1 |
FON2C24H31 |
ABC2D24E31 |
-58.79 |
2.19 |
-8.31 |
-0.09 |
0 |
|
|
322849 |
126671453 |
1 |
ClON2C24H31 |
ABC2D24E31 |
-21.05 |
1.47 |
-8.4 |
-0.11 |
0 |
|
|
322850 |
126671454 |
1 |
O2N7C35H43 |
A2B7C35D43 |
10.29 |
0.33 |
-8.71 |
-0.64 |
0 |
|
|
322851 |
126671456 |
1 |
ON3C23H31 |
AB3C23D31 |
-2.01 |
2.25 |
-8.29 |
-0.36 |
0 |
|
|
322852 |
126671457 |
1 |
ON2C25H34 |
AB2C25D34 |
-19.16 |
1.51 |
-8.67 |
0.17 |
0 |
|
|
322853 |
126671458 |
1 |
ClS2O6N9C54H60 |
AB2C6D9E54F60 |
-129.15 |
10.84 |
-9.05 |
-1.57 |
0 |
|
|
322854 |
126671461 |
1 |
ClSO5N12C53H57 |
ABC5D12E53F57 |
-12.61 |
7.04 |
-9.04 |
-1.47 |
0 |
|
|
322855 |
126671464 |
1 |
ClSO5N11C54H58 |
ABC5D11E54F58 |
-14.58 |
16.01 |
-8.45 |
-1.52 |
0 |
|
|
322856 |
126671465 |
1 |
O3N7C38H49 |
A3B7C38D49 |
-40.75 |
4.18 |
-8.45 |
-0.37 |
0 |
|
|
322857 |
126671477 |
2 |
OC9H12 |
AB9C12 |
-57.0 |
2.81 |
-9.0 |
-0.1 |
0 |
|
|
322858 |
126671480 |
1 |
BrF2O3N6H25C28 |
AB2C3D6E25F28 |
-103.62 |
9.89 |
-8.96 |
-1.35 |
0 |
|
|
322859 |
126671481 |
1 |
ClN3O4C24H36 |
AB3C4D24E36 |
-219.31 |
4.93 |
-9.3 |
-0.04 |
0 |
|
|
322860 |
126671482 |
1 |
N4O4C25H36 |
A4B4C25D36 |
-177.4 |
7.28 |
-9.75 |
-0.58 |
0 |
|
|
322861 |
126671483 |
1 |
SN4O4C27H38 |
AB4C4D27E38 |
-174.76 |
4.72 |
-9.0 |
-0.57 |
0 |
|
|
322862 |
126671484 |
1 |
O3N6C27H28 |
A3B6C27D28 |
-18.9 |
6.26 |
-8.82 |
-0.47 |
0 |
|
|
322863 |
126671485 |
1 |
O2N5C19H23 |
A2B5C19D23 |
-42.67 |
2.69 |
-8.87 |
-0.73 |
0 |
|
|
322864 |
126671486 |
1 |
O4N5C30H41 |
A4B5C30D41 |
-129.43 |
5.41 |
-9.02 |
-0.83 |
0 |
|
|
322865 |
126671487 |
1 |
O4N5C30H41 |
A4B5C30D41 |
-105.33 |
6.0 |
-9.08 |
-0.57 |
0 |
|
|
322866 |
126671488 |
1 |
N4O4C25H38 |
A4B4C25D38 |
-185.22 |
8.38 |
-9.61 |
-0.48 |
0 |
|
|
322867 |
126671489 |
1 |
ClFO3N6H30C31 |
ABC3D6E30F31 |
-53.3 |
5.95 |
-9.12 |
-0.98 |
0 |
|
|
322868 |
126671490 |
3 |
NOC5H5 |
ABC5D5 |
-85.99 |
4.85 |
-9.12 |
-0.73 |
0 |
|
|
322869 |
126671492 |
1 |
O2N3H23C25 |
A2B3C23D25 |
55.4 |
2.58 |
-9.42 |
-0.98 |
0 |
|
|
322870 |
126671493 |
1 |
NOF2C13H27 |
ABC2D13E27 |
-208.13 |
4.72 |
-8.96 |
2.13 |
0 |
|
|
322871 |
126671495 |
1 |
ON6C33H54 |
AB6C33D54 |
-22.63 |
1.19 |
-8.18 |
-0.01 |
0 |
|
|
322872 |
126671496 |
1 |
ON5C19H25 |
AB5C19D25 |
3.6 |
0.53 |
-8.59 |
-0.56 |
0 |
|
|
322873 |
126671499 |
1 |
NO2C10H21 |
AB2C10D21 |
-107.6 |
4.84 |
-9.04 |
0.67 |
0 |
|
|
322874 |
126671500 |
2 |
NOC7H10 |
ABC7D10 |
-57.29 |
4.41 |
-9.06 |
-0.11 |
0 |
|
|
322875 |
126671506 |
1 |
FNO2C14H18 |
ABC2D14E18 |
-102.75 |
4.1 |
-9.22 |
-0.78 |
0 |
|
|
322876 |
126671507 |
1 |
FNO2C14H18 |
ABC2D14E18 |
-100.45 |
6.09 |
-9.06 |
-0.75 |
0 |
|
|
322877 |
126671511 |
1 |
ClS2O7N9C51H56 |
AB2C7D9E51F56 |
-163.78 |
4.14 |
-8.99 |
-1.42 |
0 |
|
|
322878 |
126671512 |
1 |
NSO2C15H31 |
ABC2D15E31 |
-126.15 |
2.54 |
-8.64 |
0.66 |
0 |
|
|
322879 |
126671515 |
1 |
SN6O10C54H62 |
AB6C10D54E62 |
-279.3 |
13.18 |
-8.36 |
-0.91 |
0 |
|
|
322880 |
126671520 |
1 |
ON5C10H11 |
AB5C10D11 |
28.4 |
2.12 |
-8.62 |
-0.61 |
0 |
|
|
322881 |
126671522 |
1 |
ON3C25H35 |
AB3C25D35 |
-4.07 |
1.15 |
-8.24 |
-0.12 |
0 |
|
|
322882 |
126671524 |
1 |
SN5O6C33H49 |
AB5C6D33E49 |
-272.89 |
7.68 |
-9.06 |
-0.81 |
0 |
|
|
322883 |
126671528 |
1 |
N2O4C15H24 |
A2B4C15D24 |
-140.11 |
3.59 |
-8.28 |
-0.04 |
0 |
|
|
322884 |
126671529 |
1 |
NO3C18H25 |
AB3C18D25 |
-72.34 |
1.51 |
-8.97 |
-0.22 |
0 |
|
|
322885 |
126671531 |
1 |
NO3C18H25 |
AB3C18D25 |
-70.96 |
2.17 |
-8.92 |
-0.24 |
0 |
|
|
322886 |
126671534 |
1 |
NO3C12H25 |
AB3C12D25 |
-147.25 |
1.41 |
-8.99 |
0.49 |
0 |
|
|
322887 |
126671535 |
1 |
NO3C9H19 |
AB3C9D19 |
-133.92 |
3.49 |
-9.27 |
0.55 |
0 |
|
|
322888 |
126671536 |
1 |
NO3C14H29 |
AB3C14D29 |
-155.52 |
2.08 |
-8.99 |
0.51 |
0 |
|
|
322889 |
126671537 |
1 |
ClFSO6N10C53H60 |
ABCD6E10F53G60 |
-185.12 |
13.22 |
-8.94 |
-0.71 |
0 |
|
|
322890 |
126671540 |
1 |
NOC19H23 |
ABC19D23 |
-11.99 |
2.16 |
-8.15 |
0.26 |
0 |
|
|
322891 |
126671541 |
1 |
FC13H17 |
AB13C17 |
-54.21 |
1.44 |
-9.47 |
0.09 |
0 |
|
|
322892 |
126671543 |
1 |
ClC13H15 |
AB13C15 |
43.08 |
2.0 |
-9.28 |
0.04 |
0 |
|
|
322893 |
126671544 |
1 |
ClFO2H12C15 |
ABC2D12E15 |
-95.07 |
4.43 |
-9.74 |
-1.22 |
0 |
|
|
322894 |
126671545 |
1 |
FC13H15 |
AB13C15 |
-21.78 |
1.24 |
-9.47 |
0.11 |
0 |
|
|
322895 |
126671546 |
1 |
ClC13H15 |
AB13C15 |
15.19 |
1.44 |
-9.35 |
0.02 |
0 |
|
|
322896 |
126671547 |
1 |
ClFNOC19H21 |
ABCDE19F21 |
-71.69 |
3.75 |
-9.37 |
-0.63 |
0 |
|
|
322897 |
126671548 |
1 |
ClFNOC18H19 |
ABCDE18F19 |
-67.27 |
4.06 |
-9.48 |
-0.84 |
0 |
|
|
322898 |
126671549 |
1 |
FC13H15 |
AB13C15 |
7.1 |
1.81 |
-9.41 |
0.15 |
0 |
|
|
322899 |
126671552 |
1 |
N3C10H13 |
A3B10C13 |
47.48 |
3.5 |
-9.29 |
-0.64 |
0 |
|
|
322900 |
126671553 |
1 |
ON3H9C10 |
AB3C9D10 |
41.39 |
4.97 |
-9.76 |
-0.8 |
0 |
|
|
322901 |
126671555 |
1 |
SN2O3C8H10 |
AB2C3D8E10 |
-75.02 |
6.99 |
-9.88 |
-0.75 |
0 |
|
|
322902 |
126671556 |
1 |
ON3C9H11 |
AB3C9D11 |
16.52 |
5.71 |
-9.7 |
-0.92 |
0 |
|
|
322903 |
126671557 |
2 |
NOC5H7 |
ABC5D7 |
-66.59 |
3.3 |
-9.6 |
-0.16 |
0 |
|
|
322904 |
126671558 |
3 |
NC4H7 |
AB4C7 |
1.87 |
1.05 |
-8.66 |
-0.03 |
0 |
|
|
322905 |
126671559 |
1 |
SO3N10H24C25 |
AB3C10D24E25 |
59.17 |
8.26 |
-9.05 |
-1.56 |
0 |
|
|
322906 |
126671560 |
1 |
NF3C9H12 |
AB3C9D12 |
-156.16 |
3.17 |
-8.46 |
0.13 |
0 |
|
|
322907 |
126671561 |
1 |
ClSF2H7C12 |
ABC2D7E12 |
-55.68 |
1.02 |
-8.82 |
-0.92 |
0 |
|
|
322908 |
126671562 |
1 |
BrNC8H12 |
ABC8D12 |
-7.62 |
4.3 |
-8.25 |
-0.26 |
0 |
|
|
322909 |
126671563 |
1 |
NOC8H17 |
ABC8D17 |
-67.56 |
2.16 |
-9.19 |
2.23 |
0 |
|
|
322910 |
126671564 |
1 |
N2C7H16 |
A2B7C16 |
-25.66 |
0.13 |
-9.33 |
3.48 |
0 |
|
|
322911 |
126671565 |
2 |
NOC9H13 |
ABC9D13 |
-84.06 |
0.96 |
-8.77 |
0.17 |
0 |
|
|
322912 |
126671566 |
1 |
ON3C24H33 |
AB3C24D33 |
-2.65 |
1.9 |
-8.22 |
-0.01 |
0 |
|
|
322913 |
126671567 |
1 |
O2C7H14 |
A2B7C14 |
-112.52 |
3.6 |
-9.99 |
0.31 |
0 |
|
|
322914 |
126671569 |
1 |
O2C7H14 |
A2B7C14 |
-112.03 |
3.5 |
-10.01 |
0.28 |
0 |
|
|
322915 |
126671571 |
2 |
OC4H8 |
AB4C8 |
-117.41 |
3.06 |
-9.98 |
0.62 |
0 |
|
|
322916 |
126671572 |
1 |
ClON2H9C10 |
ABC2D9E10 |
32.22 |
3.27 |
-9.82 |
-1.16 |
0 |
|
|
322917 |
126671574 |
1 |
ON3C10H15 |
AB3C10D15 |
-8.41 |
3.82 |
-8.4 |
0.79 |
0 |
|
|
322918 |
126671575 |
1 |
NO2C11H13 |
AB2C11D13 |
-72.06 |
2.6 |
-8.76 |
-0.29 |
0 |
|
|
322919 |
126671576 |
2 |
NC7H7 |
AB7C7 |
52.98 |
1.45 |
-8.48 |
0.18 |
0 |
|
|
322920 |
126671579 |
1 |
ClNOC12H14 |
ABCD12E14 |
-39.37 |
3.59 |
-9.13 |
-0.13 |
0 |
|
|
322921 |
126671583 |
1 |
ClN3O3C35H44 |
AB3C3D35E44 |
-104.71 |
4.78 |
-8.33 |
-0.25 |
0 |
|
|
322922 |
126671584 |
1 |
OC16H24 |
AB16C24 |
-52.67 |
1.54 |
-9.37 |
0.35 |
0 |
|
|
322923 |
126671585 |
1 |
ON2C10H16 |
AB2C10D16 |
-34.57 |
6.61 |
-8.9 |
0.02 |
0 |
|
|
322924 |
126671586 |
1 |
FN3C14H18 |
AB3C14D18 |
-2.06 |
5.24 |
-8.19 |
-0.31 |
0 |
|
|
322925 |
126671588 |
1 |
ON3C20H27 |
AB3C20D27 |
4.51 |
2.47 |
-8.62 |
0.01 |
0 |
|
|
322926 |
126671591 |
2 |
NOC12H16 |
ABC12D16 |
-59.48 |
1.35 |
-8.57 |
0.03 |
0 |
|
|
322927 |
126671595 |
1 |
O2C19H30 |
A2B19C30 |
-116.97 |
1.12 |
-8.52 |
0.51 |
0 |
|
|
322928 |
126671598 |
1 |
ON5C22H29 |
AB5C22D29 |
-3.91 |
5.41 |
-8.54 |
-0.55 |
0 |
|
|
322929 |
126671599 |
1 |
N2S2O4C13H22 |
A2B2C4D13E22 |
-147.4 |
3.44 |
-8.95 |
0.0 |
0 |
|
|
322930 |
126671600 |
1 |
N2S2O4C9H16 |
A2B2C4D9E16 |
-123.35 |
7.22 |
-9.12 |
-0.08 |
0 |
|
|
322931 |
126671603 |
1 |
O2N5C23H29 |
A2B5C23D29 |
-54.26 |
6.52 |
-8.89 |
-0.67 |
0 |
|
|
322932 |
126671605 |
1 |
N2O4C7H8 |
A2B4C7D8 |
-105.87 |
4.28 |
-9.82 |
-1.76 |
0 |
|
|
322933 |
126671606 |
1 |
SN4O4C28H40 |
AB4C4D28E40 |
-182.79 |
1.97 |
-9.22 |
-0.74 |
0 |