List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
314016 |
126619576 |
1 |
NO3C17H27 |
AB3C17D27 |
-135.93 |
1.72 |
-9.04 |
-0.07 |
0 |
|
|
314017 |
126619577 |
1 |
NO3C17H29 |
AB3C17D29 |
-147.75 |
1.86 |
-9.03 |
-0.07 |
0 |
|
|
314018 |
126619600 |
2 |
NO2C17H28 |
AB2C17D28 |
-201.04 |
1.85 |
-8.55 |
-0.07 |
0 |
|
|
314019 |
126619606 |
1 |
NOC18H31 |
ABC18D31 |
-69.49 |
3.34 |
-8.69 |
0.42 |
0 |
|
|
314020 |
126619616 |
1 |
N2O5C28H44 |
A2B5C28D44 |
-201.09 |
3.16 |
-8.22 |
0.09 |
0 |
|
|
314021 |
126619626 |
1 |
ISN4O4C23H29 |
ABC4D4E23F29 |
-133.25 |
3.01 |
-9.19 |
-1.86 |
0 |
|
|
314022 |
126619689 |
1 |
SN2O3C17H22 |
AB2C3D17E22 |
-113.34 |
3.33 |
-9.32 |
-0.87 |
0 |
|
|
314023 |
126619698 |
1 |
S2O8N9C54H63 |
A2B8C9D54E63 |
-209.87 |
14.8 |
-8.61 |
-1.21 |
0 |
|
|
314024 |
126619700 |
1 |
INO2C14H14 |
ABC2D14E14 |
-10.34 |
3.04 |
-8.62 |
-1.15 |
0 |
|
|
314025 |
126619737 |
1 |
N3O6C49H79 |
A3B6C49D79 |
-305.59 |
5.4 |
-8.61 |
-0.1 |
0 |
|
|
314026 |
126619740 |
1 |
O2N3H15C24 |
A2B3C15D24 |
105.42 |
2.35 |
-8.62 |
-1.32 |
0 |
|
|
314027 |
126619755 |
1 |
ClS2O8N9C57H68 |
AB2C8D9E57F68 |
-222.24 |
10.66 |
-8.89 |
-1.47 |
0 |
|
|
314028 |
126619756 |
4 |
OC3H5 |
AB3C5 |
-149.3 |
2.73 |
-9.95 |
0.97 |
0 |
|
|
314029 |
126619763 |
1 |
NO7C25H41 |
AB7C25D41 |
-338.09 |
5.12 |
-8.78 |
0.23 |
0 |
|
|
314030 |
126619772 |
1 |
O5C13H24 |
A5B13C24 |
-254.29 |
1.43 |
-10.26 |
0.49 |
0 |
|
|
314031 |
126619781 |
1 |
ClS2O7N11C58H64 |
AB2C7D11E58F64 |
-120.27 |
8.94 |
-9.28 |
-1.32 |
0 |
|
|
314032 |
126619784 |
1 |
N3O6C28H33 |
A3B6C28D33 |
-182.4 |
7.3 |
-9.12 |
-0.92 |
0 |
|
|
314033 |
126619870 |
1 |
ON2C15H24 |
AB2C15D24 |
-35.91 |
3.41 |
-8.86 |
0.26 |
0 |
|
|
314034 |
126619872 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-76.21 |
4.19 |
-8.28 |
0.41 |
0 |
|
|
314035 |
126619873 |
2 |
NOC8H10 |
ABC8D10 |
-53.66 |
4.42 |
-9.12 |
-0.42 |
0 |
|
|
314036 |
126619879 |
1 |
NOC15H23 |
ABC15D23 |
-29.35 |
2.18 |
-8.67 |
0.49 |
0 |
|
|
314037 |
126619881 |
1 |
ON2C15H24 |
AB2C15D24 |
-38.59 |
1.97 |
-8.92 |
0.03 |
0 |
|
|
314038 |
126619885 |
1 |
ClS2O5N11C56H62 |
AB2C5D11E56F62 |
-66.43 |
21.07 |
-8.9 |
-1.71 |
0 |
|
|
314040 |
126619888 |
1 |
ClS2O8N10C58H65 |
AB2C8D10E58F65 |
-184.37 |
6.73 |
-8.64 |
-1.51 |
0 |
|
|
314041 |
126619890 |
1 |
ClS2O8N10C61H71 |
AB2C8D10E61F71 |
-199.85 |
9.93 |
-8.96 |
-1.53 |
0 |
|
|
314042 |
126619901 |
2 |
N2O2C11H13 |
A2B2C11D13 |
-88.07 |
3.5 |
-9.82 |
-0.92 |
0 |
|
|
314043 |
126619957 |
1 |
N2O4C15H28 |
A2B4C15D28 |
-231.36 |
3.96 |
-9.33 |
0.43 |
0 |
|
|
314044 |
126619995 |
1 |
N2O5C18H32 |
A2B5C18D32 |
-255.95 |
4.9 |
-9.03 |
0.7 |
0 |
|
|
314045 |
126620052 |
1 |
O3N5C22H27 |
A3B5C22D27 |
-51.53 |
5.0 |
-8.37 |
-1.07 |
0 |
|
|
314046 |
126620091 |
1 |
NSO3C14H31 |
ABC3D14E31 |
-174.28 |
4.52 |
-9.09 |
0.96 |
0 |
|
|
314047 |
126620092 |
1 |
ClS2N9O11C55H72 |
AB2C9D11E55F72 |
-354.6 |
11.61 |
-9.34 |
-1.46 |
0 |
|
|
314048 |
126620093 |
1 |
NO2C11H23 |
AB2C11D23 |
-98.78 |
1.81 |
-9.48 |
0.78 |
0 |
|
|
314049 |
126620094 |
1 |
SN5O10C36H57 |
AB5C10D36E57 |
-406.74 |
2.36 |
-9.16 |
-0.73 |
0 |
|
|
314050 |
126620098 |
1 |
SN4O10C36H56 |
AB4C10D36E56 |
-411.47 |
5.79 |
-8.91 |
-0.4 |
0 |
|
|
314051 |
126620102 |
1 |
ClS2N9O9C52H66 |
AB2C9D9E52F66 |
-267.82 |
15.54 |
-8.15 |
-1.6 |
0 |
|
|
314052 |
126620125 |
1 |
BrSN2O3H15C17 |
ABC2D3E15F17 |
-50.61 |
9.35 |
-9.19 |
-1.98 |
0 |
|
|
314053 |
126620153 |
1 |
N2O3C14H20 |
A2B3C14D20 |
-118.73 |
4.56 |
-9.75 |
-0.23 |
0 |
|
|
314054 |
126620154 |
1 |
ClF2S2O6N9C48H52 |
AB2C2D6E9F48G52 |
-187.15 |
8.55 |
-9.14 |
-1.34 |
0 |
|
|
314055 |
126620156 |
1 |
SO8N9C63H75 |
AB8C9D63E75 |
-172.8 |
14.77 |
-8.63 |
-1.16 |
0 |
|
|
314056 |
126620158 |
1 |
NSF2O4C12H15 |
ABC2D4E12F15 |
-207.95 |
7.24 |
-9.49 |
-0.83 |
0 |
|
|
314057 |
126620167 |
1 |
ClS2O5N11C55H72 |
AB2C5D11E55F72 |
-111.74 |
12.45 |
-8.63 |
-1.29 |
0 |
|
|
314058 |
126620199 |
1 |
NO3C9H19 |
AB3C9D19 |
-130.96 |
4.29 |
-9.13 |
0.49 |
0 |
|
|
314059 |
126620207 |
1 |
NI2O3H9C11 |
AB2C3D9E11 |
-21.55 |
4.86 |
-8.95 |
-2.05 |
0 |
|
|
314060 |
126620211 |
1 |
FNO2C14H20 |
ABC2D14E20 |
-126.26 |
1.7 |
-8.94 |
-0.18 |
0 |
|
|
314061 |
126620218 |
1 |
NO3C14H17 |
AB3C14D17 |
-78.63 |
5.07 |
-8.91 |
-1.09 |
0 |
|
|
314062 |
126620219 |
1 |
FNOC11H16 |
ABCD11E16 |
-85.43 |
3.32 |
-8.97 |
0.32 |
0 |
|
|
314063 |
126620222 |
1 |
FINO2H13C14 |
ABCD2E13F14 |
-16.19 |
5.98 |
-9.31 |
-2.1 |
0 |
|
|
314064 |
126620237 |
1 |
ClS2O6N10C54H69 |
AB2C6D10E54F69 |
-165.4 |
1.67 |
-8.86 |
-0.88 |
0 |
|
|
314065 |
126620241 |
1 |
ClS2O5N11C54H68 |
AB2C5D11E54F68 |
-105.89 |
11.61 |
-8.42 |
-1.42 |
0 |
|
|
314066 |
126620248 |
1 |
FN2O5C13H15 |
AB2C5D13E15 |
-243.96 |
6.67 |
-10.21 |
-1.13 |
0 |
|
|
314067 |
126620251 |
1 |
ClN4C14H17 |
AB4C14D17 |
36.42 |
2.05 |
-8.56 |
0.05 |
0 |
|
|
314068 |
126620270 |
1 |
ClN3O4C26H30 |
AB3C4D26E30 |
-157.46 |
7.32 |
-9.19 |
-0.9 |
0 |
|
|
314069 |
126620274 |
1 |
SO3N4C31H38 |
AB3C4D31E38 |
-83.11 |
3.12 |
-9.05 |
-0.62 |
0 |
|
|
314070 |
126620276 |
1 |
ISO3N5C25H28 |
ABC3D5E25F28 |
-19.25 |
2.11 |
-9.31 |
-0.97 |
0 |
|
|
314071 |
126620281 |
1 |
IO4N5C24H28 |
AB4C5D24E28 |
-73.24 |
3.1 |
-9.08 |
-1.03 |
0 |
|
|
314072 |
126620283 |
1 |
SO4N5C26H33 |
AB4C5D26E33 |
-113.92 |
4.97 |
-9.4 |
-0.82 |
0 |
|
|
314073 |
126620303 |
1 |
O3C10H16 |
A3B10C16 |
-112.83 |
2.49 |
-9.89 |
0.79 |
0 |
|
|
314074 |
126620307 |
1 |
N2O5C26H34 |
A2B5C26D34 |
-197.8 |
5.24 |
-8.3 |
0.05 |
0 |
|
|
314075 |
126620324 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-79.03 |
5.62 |
-8.74 |
0.96 |
0 |
|
|
314076 |
126620337 |
1 |
NO6C21H23 |
AB6C21D23 |
-140.13 |
6.96 |
-9.34 |
-0.73 |
0 |
|
|
314077 |
126620340 |
1 |
O2N5C16H17 |
A2B5C16D17 |
-21.09 |
7.96 |
-8.87 |
-0.43 |
0 |
|
|
314078 |
126620342 |
1 |
ON4C16H18 |
AB4C16D18 |
29.06 |
3.67 |
-8.25 |
-0.18 |
0 |
|
|
314079 |
126620343 |
1 |
ON4C17H20 |
AB4C17D20 |
31.3 |
3.36 |
-8.31 |
-0.25 |
0 |
|
|
314082 |
126620362 |
1 |
NC11H23 |
AB11C23 |
-19.38 |
1.52 |
-8.71 |
2.71 |
0 |
|
|
314083 |
126620363 |
1 |
FO5C31H37 |
AB5C31D37 |
-199.74 |
2.18 |
-8.48 |
-0.24 |
0 |
|
|
314084 |
126620364 |
1 |
ISN3O4H16C21 |
ABC3D4E16F21 |
-10.67 |
7.8 |
-9.15 |
-1.4 |
0 |
|
|
314085 |
126620365 |
2 |
O3C7H7 |
A3B7C7 |
-237.96 |
9.16 |
-10.89 |
-0.37 |
0 |
|
|
314086 |
126620366 |
1 |
NO2C14H15 |
AB2C14D15 |
-50.83 |
2.95 |
-8.49 |
-0.3 |
0 |
|
|
314087 |
126620369 |
1 |
NO7C18H19 |
AB7C18D19 |
-162.69 |
7.91 |
-9.4 |
-0.6 |
0 |
|
|
314088 |
126620374 |
1 |
F3O3H17C19 |
A3B3C17D19 |
-216.45 |
4.27 |
-8.7 |
-1.05 |
0 |
|
|
314089 |
126620375 |
1 |
IO3C9H9 |
AB3C9D9 |
-69.55 |
5.17 |
-9.0 |
-1.24 |
0 |
|
|
314090 |
126620376 |
1 |
NSO3C13H15 |
ABC3D13E15 |
-74.31 |
4.56 |
-8.84 |
-0.77 |
0 |
|
|
314091 |
126620380 |
1 |
OH14C17 |
AB14C17 |
28.09 |
0.7 |
-8.57 |
-0.34 |
0 |
|
|
314092 |
126620383 |
1 |
ClSO2N8H13C17 |
ABC2D8E13F17 |
155.28 |
2.71 |
-8.97 |
-1.92 |
0 |
|
|
314093 |
126620384 |
1 |
ClN2O5H17C18 |
AB2C5D17E18 |
-89.74 |
4.11 |
-10.15 |
-1.28 |
0 |