List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
203945 |
79892843 |
1 |
ON3C15H21 |
AB3C15D21 |
-15.49 |
2.62 |
-8.14 |
0.0 |
0 |
|
|
203946 |
79892844 |
1 |
ON3C15H23 |
AB3C15D23 |
-29.38 |
2.19 |
-8.1 |
0.07 |
0 |
|
|
203947 |
79892845 |
1 |
SN3O3C11H15 |
AB3C3D11E15 |
-80.54 |
4.14 |
-8.28 |
-0.14 |
0 |
|
|
203948 |
79892846 |
1 |
SN3O3C12H15 |
AB3C3D12E15 |
-84.95 |
4.8 |
-8.14 |
-0.09 |
0 |
|
|
203949 |
79892961 |
1 |
OF3N4H7C11 |
AB3C4D7E11 |
-91.55 |
7.11 |
-8.82 |
-1.25 |
0 |
|
|
203950 |
79893013 |
1 |
ON3C14H19 |
AB3C14D19 |
-11.3 |
3.16 |
-8.11 |
0.04 |
0 |
|
|
203951 |
79893430 |
2 |
ON2C7H9 |
AB2C7D9 |
-38.45 |
1.68 |
-8.24 |
-0.13 |
0 |
|
|
203952 |
79893504 |
2 |
ON2C6H6 |
AB2C6D6 |
29.27 |
1.66 |
-8.32 |
-0.42 |
0 |
|
|
203953 |
79893505 |
1 |
O2N4C13H18 |
A2B4C13D18 |
-47.12 |
4.97 |
-8.17 |
-0.03 |
0 |
|
|
203954 |
79893506 |
1 |
ON4C13H20 |
AB4C13D20 |
2.02 |
2.82 |
-8.11 |
0.04 |
0 |
|
|
203955 |
79893507 |
1 |
O2N3C15H15 |
A2B3C15D15 |
0.56 |
1.21 |
-8.2 |
-0.24 |
0 |
|
|
203956 |
79893508 |
1 |
ON3C15H15 |
AB3C15D15 |
33.36 |
1.4 |
-8.06 |
-0.11 |
0 |
|
|
203957 |
79893509 |
1 |
O2N3C13H17 |
A2B3C13D17 |
-43.41 |
0.47 |
-8.27 |
-0.13 |
0 |
|
|
203958 |
79893510 |
1 |
ON3C15H21 |
AB3C15D21 |
-12.73 |
2.15 |
-8.03 |
0.06 |
0 |
|
|
203959 |
79893511 |
1 |
FON4H9C14 |
ABC4D9E14 |
27.52 |
4.57 |
-8.49 |
-1.16 |
0 |
|
|
203960 |
79893717 |
1 |
NSO2C13H23 |
ABC2D13E23 |
-110.08 |
4.16 |
-8.43 |
0.73 |
0 |
|
|
203961 |
79893731 |
1 |
O2C13H22 |
A2B13C22 |
-112.6 |
3.08 |
-9.69 |
0.6 |
0 |
|
|
203962 |
79893732 |
2 |
OC6H10 |
AB6C10 |
-104.11 |
3.58 |
-9.62 |
0.6 |
0 |
|
|
203963 |
79893733 |
1 |
O3C13H22 |
A3B13C22 |
-160.74 |
3.29 |
-9.64 |
0.56 |
0 |
|
|
203964 |
79893734 |
3 |
OC5H8 |
AB5C8 |
-153.85 |
2.42 |
-9.65 |
0.97 |
0 |
|
|
203965 |
79893816 |
1 |
NO4C14H23 |
AB4C14D23 |
-188.52 |
3.7 |
-9.49 |
0.4 |
0 |
|
|
203966 |
79893887 |
1 |
NSO3C14H23 |
ABC3D14E23 |
-149.07 |
6.19 |
-8.58 |
0.48 |
0 |
|
|
203967 |
79894246 |
1 |
NO3C15H27 |
AB3C15D27 |
-167.9 |
3.93 |
-9.45 |
1.88 |
0 |
|
|
203968 |
79894519 |
1 |
NO4C14H25 |
AB4C14D25 |
-200.79 |
7.95 |
-9.6 |
1.01 |
0 |
|
|
203969 |
79894520 |
1 |
NO3C16H27 |
AB3C16D27 |
-170.82 |
4.31 |
-9.23 |
0.63 |
0 |
|
|
203970 |
79894521 |
1 |
NO3C16H27 |
AB3C16D27 |
-163.3 |
3.76 |
-8.92 |
0.58 |
0 |
|
|
203971 |
79894707 |
1 |
NO2C14H27 |
AB2C14D27 |
-111.24 |
3.88 |
-8.79 |
2.1 |
0 |
|
|
203972 |
79895123 |
1 |
N2O2C13H24 |
A2B2C13D24 |
-108.7 |
2.74 |
-9.62 |
1.05 |
0 |
|
|
203973 |
79895304 |
1 |
SN2O2C15H28 |
AB2C2D15E28 |
-101.78 |
3.51 |
-8.51 |
0.62 |
0 |
|
|
203974 |
79895430 |
1 |
BrFNO2C15H19 |
ABCD2E15F19 |
-117.64 |
1.97 |
-9.42 |
-0.48 |
0 |
|
|
203975 |
79895431 |
1 |
ClNO2C16H22 |
ABC2D16E22 |
-89.02 |
2.66 |
-9.29 |
-0.09 |
0 |
|
|
203976 |
79895432 |
1 |
BrNOSC16H22 |
ABCDE16F22 |
-36.68 |
2.96 |
-8.43 |
-0.26 |
0 |
|
|
203977 |
79895433 |
1 |
OSN3C13H21 |
ABC3D13E21 |
-23.81 |
5.32 |
-8.85 |
0.28 |
0 |
|
|
203978 |
79896062 |
1 |
SN3O3C12H21 |
AB3C3D12E21 |
-129.43 |
6.69 |
-8.18 |
-0.17 |
0 |
|
|
203979 |
79896250 |
1 |
NO3C10H17 |
AB3C10D17 |
-140.04 |
8.26 |
-9.15 |
0.02 |
0 |
|
|
203980 |
79896251 |
1 |
NO3C11H19 |
AB3C11D19 |
-140.25 |
2.96 |
-8.97 |
0.08 |
0 |
|
|
203981 |
79896400 |
1 |
FSN2O3C11H15 |
ABC2D3E11F15 |
-157.2 |
5.85 |
-9.04 |
-0.85 |
0 |
|
|
203982 |
79896508 |
1 |
NO2C12H23 |
AB2C12D23 |
-112.67 |
4.91 |
-8.63 |
0.46 |
0 |
|
|
203983 |
79896557 |
1 |
SN3O3C13H21 |
AB3C3D13E21 |
-115.5 |
5.35 |
-8.51 |
-0.46 |
0 |
|
|
203984 |
79896558 |
1 |
SO2N3C12H19 |
AB2C3D12E19 |
-45.05 |
5.13 |
-8.55 |
-0.49 |
0 |
|
|
203985 |
79896764 |
2 |
NOC5H9 |
ABC5D9 |
-87.93 |
7.21 |
-9.11 |
-0.02 |
0 |
|
|
203986 |
79896797 |
1 |
N2O3C10H18 |
A2B3C10D18 |
-128.44 |
6.25 |
-9.12 |
0.0 |
0 |
|
|
203987 |
79897023 |
1 |
SN3O4C10H17 |
AB3C4D10E17 |
-157.52 |
5.17 |
-8.42 |
-0.46 |
0 |
|
|
203988 |
79897638 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-44.1 |
6.05 |
-8.83 |
-0.4 |
0 |
|
|
203989 |
79897641 |
1 |
NO2C16H23 |
AB2C16D23 |
-83.26 |
4.05 |
-8.31 |
0.46 |
0 |
|
|
203990 |
79897674 |
1 |
ON2C17H26 |
AB2C17D26 |
-25.2 |
4.23 |
-8.92 |
0.19 |
0 |
|
|
203991 |
79897675 |
1 |
ON2C13H26 |
AB2C13D26 |
-57.98 |
2.98 |
-8.65 |
2.4 |
0 |
|
|
203992 |
79897676 |
1 |
ON2C15H30 |
AB2C15D30 |
-80.09 |
2.9 |
-8.64 |
2.43 |
0 |
|
|
203993 |
79897677 |
1 |
ON2C16H32 |
AB2C16D32 |
-84.12 |
2.89 |
-8.53 |
2.58 |
0 |
|
|
203994 |
79897678 |
1 |
ON2C16H24 |
AB2C16D24 |
-25.59 |
2.39 |
-8.05 |
0.45 |
0 |