List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
311061 |
126589027 |
1 |
NSO3C20H25 |
ABC3D20E25 |
-90.2 |
2.76 |
-8.5 |
-0.15 |
0 |
|
|
311062 |
126589045 |
1 |
ClNO2C18H20 |
ABC2D18E20 |
-61.67 |
2.93 |
-8.86 |
-0.2 |
0 |
|
|
311063 |
126589048 |
1 |
ClNF2O2C19H20 |
ABC2D2E19F20 |
-166.87 |
3.09 |
-8.96 |
-0.36 |
0 |
|
|
311064 |
126589049 |
1 |
ClNO2C20H24 |
ABC2D20E24 |
-76.41 |
6.97 |
-9.01 |
-0.29 |
0 |
|
|
311065 |
126589061 |
1 |
BrNO3C19H22 |
ABC3D19E22 |
-105.85 |
2.23 |
-8.45 |
-0.51 |
0 |
|
|
311066 |
126589066 |
1 |
NCl2O2C19H21 |
AB2C2D19E21 |
-79.47 |
3.55 |
-8.49 |
-0.2 |
0 |
|
|
311067 |
126589069 |
1 |
ClNO3C21H26 |
ABC3D21E26 |
-117.38 |
6.4 |
-8.73 |
-0.16 |
0 |
|
|
311068 |
126589071 |
1 |
NO4C20H21 |
AB4C20D21 |
-105.32 |
4.46 |
-8.8 |
-1.38 |
0 |
|
|
311069 |
126589073 |
1 |
NO2F3C21H24 |
AB2C3D21E24 |
-225.5 |
5.02 |
-8.59 |
-0.83 |
0 |
|
|
311070 |
126589074 |
1 |
ClNO2C20H24 |
ABC2D20E24 |
-81.17 |
3.46 |
-8.4 |
-0.03 |
0 |
|
|
311071 |
126589081 |
1 |
ClNO2C22H26 |
ABC2D22E26 |
-57.11 |
2.72 |
-8.55 |
0.08 |
0 |
|
|
311072 |
126589086 |
1 |
NO2C22H29 |
AB2C22D29 |
-80.59 |
5.48 |
-9.06 |
-0.08 |
0 |
|
|
311073 |
126589087 |
1 |
FNO3C19H20 |
ABC3D19E20 |
-120.24 |
3.18 |
-8.62 |
-1.33 |
0 |
|
|
311074 |
126589093 |
1 |
INO3C19H20 |
ABC3D19E20 |
-56.47 |
2.34 |
-8.48 |
-1.29 |
0 |
|
|
311075 |
126589147 |
1 |
ClNF2O3C18H18 |
ABC2D3E18F18 |
-212.91 |
2.16 |
-8.68 |
-0.84 |
0 |
|
|
311076 |
126589149 |
1 |
NF2O4C20H23 |
AB2C4D20E23 |
-248.91 |
3.18 |
-8.44 |
-0.6 |
0 |
|
|
311077 |
126589174 |
1 |
NSF2O3C19H21 |
ABC2D3E19F21 |
-166.08 |
3.69 |
-8.56 |
-0.71 |
0 |
|
|
311078 |
126589175 |
1 |
NF3O3C19H20 |
AB3C3D19E20 |
-264.03 |
4.8 |
-9.2 |
-0.75 |
0 |
|
|
311079 |
126589217 |
1 |
N4O6C27H38 |
A4B6C27D38 |
-254.72 |
4.6 |
-8.65 |
-0.02 |
0 |
|
|
311080 |
126589218 |
1 |
NO2C16H21 |
AB2C16D21 |
-58.6 |
3.05 |
-8.77 |
0.47 |
0 |
|
|
311081 |
126589241 |
1 |
NSO2C21H27 |
ABC2D21E27 |
-63.71 |
4.6 |
-8.65 |
-0.34 |
0 |
|
|
311082 |
126589247 |
1 |
NSO3C20H25 |
ABC3D20E25 |
-94.98 |
3.96 |
-8.46 |
-0.49 |
0 |
|
|
311083 |
126589249 |
1 |
NF3O3C21H22 |
AB3C3D21E22 |
-242.83 |
5.56 |
-8.99 |
-0.56 |
0 |
|
|
311084 |
126589257 |
1 |
ClNF3O3H17C18 |
ABC3D3E17F18 |
-264.58 |
5.74 |
-9.16 |
-0.66 |
0 |
|
|
311085 |
126589259 |
2 |
N4O4C18H29 |
A4B4C18D29 |
-391.54 |
8.82 |
-9.29 |
0.1 |
0 |
|
|
311086 |
126589260 |
1 |
NF3O3C19H20 |
AB3C3D19E20 |
-263.58 |
3.92 |
-9.15 |
-0.53 |
0 |
|
|
311087 |
126589261 |
1 |
NF2O4C20H23 |
AB2C4D20E23 |
-246.33 |
4.54 |
-9.1 |
-0.47 |
0 |
|
|
311088 |
126589272 |
1 |
FNO3C20H24 |
ABC3D20E24 |
-166.0 |
3.57 |
-8.72 |
-0.19 |
0 |
|
|
311089 |
126589309 |
1 |
BrFNO4C18H19 |
ABCD4E18F19 |
-143.41 |
5.96 |
-8.48 |
-0.73 |
0 |
|
|
311090 |
126589313 |
1 |
FNO5C20H24 |
ABC5D20E24 |
-192.03 |
1.9 |
-8.44 |
-0.26 |
0 |
|
|
311091 |
126589333 |
1 |
FN2O2C18H21 |
AB2C2D18E21 |
-96.8 |
5.48 |
-8.32 |
-0.27 |
0 |
|
|
311092 |
126589345 |
1 |
NO2C17H33 |
AB2C17D33 |
-145.83 |
2.93 |
-9.34 |
0.89 |
0 |
|
|
311093 |
126589360 |
1 |
BrN2O2C20H25 |
AB2C2D20E25 |
-53.72 |
5.08 |
-8.59 |
-0.36 |
0 |
|
|
311094 |
126589361 |
1 |
NSO3C21H27 |
ABC3D21E27 |
-65.51 |
3.53 |
-8.62 |
-0.41 |
0 |
|
|
311095 |
126589362 |
1 |
FNSO3C19H22 |
ABCD3E19F22 |
-99.32 |
2.98 |
-8.2 |
-0.97 |
0 |
|
|
311096 |
126589373 |
1 |
N2O2C23H30 |
A2B2C23D30 |
-50.31 |
5.22 |
-8.42 |
-0.21 |
0 |
|
|
311097 |
126589392 |
1 |
NF2O2C21H25 |
AB2C2D21E25 |
-173.66 |
5.09 |
-8.54 |
-0.37 |
0 |
|
|
311098 |
126589420 |
1 |
N2O6C13H18 |
A2B6C13D18 |
-213.9 |
3.67 |
-10.03 |
-0.63 |
0 |
|
|
311099 |
126589424 |
1 |
SN5O5C18H25 |
AB5C5D18E25 |
-210.44 |
4.57 |
-9.3 |
0.18 |
0 |
|
|
311100 |
126589427 |
1 |
BrNOSC19H22 |
ABCDE19F22 |
-3.88 |
5.33 |
-8.68 |
-0.65 |
0 |
|
|
311101 |
126589428 |
1 |
FN2O3C23H23 |
AB2C3D23E23 |
-106.91 |
5.46 |
-8.54 |
-1.16 |
0 |
|
|
311102 |
126589429 |
1 |
NOC13H23 |
ABC13D23 |
-72.28 |
2.36 |
-8.94 |
0.59 |
0 |
|
|
311103 |
126589430 |
1 |
NO3C9H11 |
AB3C9D11 |
-107.26 |
4.08 |
-8.26 |
-0.37 |
0 |
|
|
311104 |
126589431 |
1 |
NOSC22H29 |
ABCD22E29 |
-23.61 |
3.86 |
-8.36 |
-0.22 |
0 |
|
|
311105 |
126589432 |
1 |
FNOSC19H22 |
ABCDE19F22 |
-54.18 |
4.59 |
-8.53 |
-0.54 |
0 |
|
|
311106 |
126589433 |
1 |
INOSC19H22 |
ABCDE19F22 |
9.68 |
4.35 |
-8.48 |
-1.01 |
0 |
|
|
311107 |
126589438 |
1 |
NO3C21H27 |
AB3C21D27 |
-84.8 |
3.05 |
-8.28 |
-0.07 |
0 |
|
|
311108 |
126589440 |
1 |
NSO2C20H25 |
ABC2D20E25 |
-48.26 |
3.62 |
-8.44 |
-0.54 |
0 |
|
|
311109 |
126589441 |
1 |
NSO2C21H27 |
ABC2D21E27 |
-54.63 |
4.5 |
-8.52 |
-0.4 |
0 |
|
|
311110 |
126589442 |
1 |
NO3C22H29 |
AB3C22D29 |
-89.58 |
3.2 |
-8.28 |
-0.07 |
0 |