List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
298964 |
117664498 |
1 |
NO5C18H19 |
AB5C18D19 |
-140.48 |
3.42 |
-9.16 |
-0.58 |
0 |
|
|
298965 |
117664520 |
1 |
O3N5C28H29 |
A3B5C28D29 |
-1.18 |
5.62 |
-8.49 |
-0.8 |
0 |
|
|
298966 |
117664556 |
1 |
O2N5C17H25 |
A2B5C17D25 |
-6.17 |
4.13 |
-7.79 |
-0.38 |
0 |
|
|
298967 |
117664566 |
1 |
O4C23H26 |
A4B23C26 |
-126.04 |
4.96 |
-9.07 |
-0.52 |
0 |
|
|
298968 |
117664595 |
1 |
NO4H15C16 |
AB4C15D16 |
-108.63 |
1.59 |
-9.37 |
-0.82 |
0 |
|
|
298969 |
117664640 |
1 |
NO5C18H19 |
AB5C18D19 |
-137.87 |
6.37 |
-9.19 |
-0.64 |
0 |
|
|
298970 |
117664681 |
1 |
O2S2N6C9H14 |
A2B2C6D9E14 |
-31.27 |
4.62 |
-9.32 |
-0.95 |
0 |
|
|
298971 |
117664788 |
1 |
ON5C19H25 |
AB5C19D25 |
3.54 |
4.95 |
-8.37 |
0.08 |
0 |
|
|
298972 |
117664807 |
1 |
NO4C20H41 |
AB4C20D41 |
-261.49 |
3.97 |
-10.14 |
0.65 |
0 |
|
|
298973 |
117664810 |
1 |
P3C29H53 |
A3B29C53 |
-112.34 |
2.42 |
-8.45 |
2.88 |
0 |
|
|
298974 |
117664837 |
1 |
KC4H6O8 |
AB4C6D8 |
-377.48 |
13.6 |
0.0 |
0.0 |
0 |
|
|
298975 |
117664915 |
1 |
Cl2N2S2O5C20H24 |
A2B2C2D5E20F24 |
-187.64 |
2.91 |
-9.18 |
-0.45 |
0 |
|
|
298976 |
117664944 |
1 |
OSN4C25H30 |
ABC4D25E30 |
17.89 |
2.96 |
-8.91 |
-1.01 |
0 |
|
|
298977 |
117664945 |
1 |
O2N3C19H29 |
A2B3C19D29 |
-92.59 |
2.27 |
-9.14 |
0.26 |
0 |
|
|
298978 |
117664948 |
1 |
SN3O4C23H29 |
AB3C4D23E29 |
-98.45 |
5.15 |
-8.43 |
-0.02 |
0 |
|
|
298979 |
117664949 |
1 |
NO2C15H23 |
AB2C15D23 |
-86.28 |
2.93 |
-8.62 |
0.23 |
0 |
|
|
298980 |
117664958 |
1 |
BrSO2N4C21H29 |
ABC2D4E21F29 |
-66.71 |
2.03 |
-8.94 |
-1.05 |
0 |
|
|
298981 |
117664993 |
1 |
SO3N5C32H35 |
AB3C5D32E35 |
-45.68 |
6.61 |
-9.07 |
-1.59 |
0 |
|
|
298982 |
117664995 |
1 |
ClO4N5H22C23 |
AB4C5D22E23 |
-89.81 |
4.67 |
-8.74 |
-1.05 |
0 |
|
|
298983 |
117665014 |
1 |
N3O4C29H31 |
A3B4C29D31 |
-78.22 |
7.16 |
-8.76 |
-0.67 |
0 |
|
|
298984 |
117665370 |
1 |
NPO2H38C41 |
ABC2D38E41 |
-1.12 |
1.62 |
-8.35 |
-0.7 |
0 |
|
|
298985 |
117665373 |
1 |
BrOC12H21 |
ABC12D21 |
-88.18 |
3.23 |
-9.92 |
-0.14 |
0 |
|
|
298986 |
117665378 |
1 |
F2O3N6C25H34 |
A2B3C6D25E34 |
-156.86 |
1.47 |
-8.41 |
-0.48 |
0 |
|
|
298987 |
117665404 |
1 |
BrSO11N36C70H125 |
ABC11D36E70F125 |
-411.22 |
19.88 |
-8.85 |
-2.06 |
0 |
|
|
298988 |
117665414 |
1 |
I4O12N34C71H124 |
A4B12C34D71E124 |
-406.86 |
10.13 |
-8.74 |
-1.84 |
0 |
|
|
298989 |
117665417 |
1 |
O12N33C75H131 |
A12B33C75D131 |
-497.49 |
8.32 |
-8.62 |
-0.19 |
0 |
|
|
298990 |
117665701 |
1 |
FN3O3C21H22 |
AB3C3D21E22 |
-57.02 |
3.26 |
-9.1 |
-0.47 |
0 |
|
|
298991 |
117665706 |
2 |
FNOH10C11 |
ABCD10E11 |
-87.93 |
4.82 |
-9.04 |
-0.36 |
0 |
|
|
298992 |
117665731 |
2 |
FNOH10C11 |
ABCD10E11 |
-88.1 |
4.48 |
-8.99 |
-0.38 |
0 |
|
|
298993 |
117665751 |
1 |
ClFNO2H13C20 |
ABCD2E13F20 |
-36.04 |
4.32 |
-9.12 |
-0.94 |
0 |
|
|
298994 |
117665755 |
1 |
ClN3O3H18C20 |
AB3C3D18E20 |
-23.0 |
4.37 |
-8.99 |
-0.6 |
0 |
|
|
298995 |
117665848 |
1 |
N2O3H20C21 |
A2B3C20D21 |
-21.29 |
4.25 |
-8.7 |
0.0 |
0 |
|
|
298996 |
117665909 |
1 |
NC16H17 |
AB16C17 |
37.13 |
1.85 |
-8.39 |
-0.28 |
0 |
|
|
298997 |
117665921 |
1 |
OSN6H28C30 |
ABC6D28E30 |
91.83 |
4.39 |
-8.71 |
-1.16 |
0 |
|
|
298998 |
117665964 |
1 |
FSN2O2C22H23 |
ABC2D2E22F23 |
-53.03 |
2.08 |
-8.91 |
-0.39 |
0 |
|
|
298999 |
117666033 |
1 |
N2O2H20C21 |
A2B2C20D21 |
6.9 |
2.39 |
-8.86 |
-0.22 |
0 |
|
|
299000 |
117666149 |
1 |
NO2H7C9 |
AB2C7D9 |
6.72 |
0.37 |
-9.58 |
-0.82 |
0 |
|
|
299001 |
117666234 |
1 |
ON7C20H25 |
AB7C20D25 |
43.05 |
7.74 |
-8.43 |
-0.46 |
0 |
|
|
299002 |
117666264 |
1 |
ClFON2C22H28 |
ABCD2E22F28 |
-108.4 |
3.64 |
-8.9 |
-0.77 |
0 |
|
|
299003 |
117666285 |
1 |
ON7C21H27 |
AB7C21D27 |
43.22 |
4.27 |
-8.32 |
-0.38 |
0 |
|
|
299004 |
117667428 |
1 |
PSN2O10C36H71 |
ABC2D10E36F71 |
-613.51 |
0.89 |
-8.88 |
0.32 |
0 |
|
|
299005 |
117667445 |
2 |
ON2H5C6 |
AB2C5D6 |
-12.75 |
3.01 |
-9.53 |
-1.04 |
0 |
|
|
299006 |
117667446 |
1 |
ClS2N4F6O6C34H35 |
AB2C4D6E6F34G35 |
-513.62 |
8.08 |
-9.53 |
-1.47 |
0 |
|
|
299007 |
117667467 |
1 |
ClO3N5C21H24 |
AB3C5D21E24 |
-91.45 |
4.44 |
-9.1 |
-0.92 |
0 |
|
|
299008 |
117667468 |
1 |
O4C49H100 |
A4B49C100 |
-410.24 |
5.46 |
-10.19 |
1.33 |
0 |
|
|
299009 |
117667470 |
1 |
ON8C30H40 |
AB8C30D40 |
27.95 |
2.86 |
-8.13 |
-0.89 |
0 |
|
|
299010 |
117667471 |
1 |
ClS2N3O5F6H26C29 |
AB2C3D5E6F26G29 |
-440.06 |
4.09 |
-9.54 |
-1.39 |
0 |
|
|
299011 |
117667487 |
1 |
O3N5C23H23 |
A3B5C23D23 |
-52.41 |
1.76 |
-8.92 |
-1.02 |
0 |
|
|
299012 |
117667496 |
1 |
O2N5C19H23 |
A2B5C19D23 |
-35.41 |
4.57 |
-8.89 |
-0.85 |
0 |
|
|
299013 |
117667537 |
1 |
N4O4H22C27 |
A4B4C22D27 |
-52.4 |
7.51 |
-8.78 |
-0.87 |
0 |