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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
277175 |
103827162 |
1 |
BrClON2H12C13 |
ABCD2E12F13 |
-3.04 |
1.45 |
-10.12 |
-1.15 |
0 |
|
|
277176 |
103827163 |
1 |
BrClON3C14H15 |
ABCD3E14F15 |
0.85 |
4.59 |
-9.23 |
-1.1 |
0 |
|
|
277177 |
103827164 |
1 |
BrClON3H11C12 |
ABCD3E11F12 |
11.79 |
1.76 |
-9.62 |
-1.06 |
0 |
|
|
277178 |
103827166 |
1 |
BrClON2H10C11 |
ABCD2E10F11 |
-3.22 |
5.15 |
-10.17 |
-1.2 |
0 |
|
|
277179 |
103827173 |
1 |
BrClNO3C13H15 |
ABCD3E13F15 |
-119.85 |
4.38 |
-9.86 |
-0.92 |
0 |
|
|
277180 |
103827178 |
1 |
BrClO2N3C10H11 |
ABC2D3E10F11 |
-70.83 |
1.63 |
-9.92 |
-1.17 |
0 |
|
|
277181 |
103827179 |
1 |
BrClNO2C14H15 |
ABCD2E14F15 |
8.28 |
4.89 |
-9.84 |
-0.84 |
0 |
|
|
277182 |
103827183 |
1 |
BrClON3C13H13 |
ABCD3E13F13 |
12.95 |
4.83 |
-9.43 |
-1.05 |
0 |
|
|
277183 |
103827193 |
1 |
BrClNO3C13H15 |
ABCD3E13F15 |
-125.32 |
3.2 |
-9.99 |
-1.08 |
0 |
|
|
277184 |
103827194 |
1 |
BrClNO3C13H17 |
ABCD3E13F17 |
-128.74 |
4.5 |
-9.95 |
-0.9 |
0 |
|
|
277185 |
103827201 |
1 |
BrClON2H12C13 |
ABCD2E12F13 |
-7.05 |
4.05 |
-9.98 |
-0.99 |
0 |
|
|
277186 |
103827202 |
1 |
BrClNO2C12H13 |
ABCD2E12F13 |
-80.83 |
5.5 |
-9.73 |
-0.77 |
0 |
|
|
277187 |
103827203 |
1 |
BrClO2N3C14H17 |
ABC2D3E14F17 |
-65.22 |
4.17 |
-9.32 |
-0.96 |
0 |
|
|
277188 |
103827204 |
1 |
BrClON2H8C11 |
ABCD2E8F11 |
34.76 |
3.76 |
-8.95 |
-1.33 |
0 |
|
|
277189 |
103827216 |
1 |
BrClNSO2C12H15 |
ABCDE2F12G15 |
-80.94 |
4.29 |
-9.12 |
-0.86 |
0 |
|
|
277190 |
103827217 |
1 |
BrClNO2C12H13 |
ABCD2E12F13 |
-56.85 |
4.73 |
-10.03 |
-1.0 |
0 |
|
|
277191 |
103827235 |
1 |
BrClNO2H13C15 |
ABCD2E13F15 |
-52.63 |
2.99 |
-9.29 |
-0.96 |
0 |
|
|
277192 |
103827239 |
1 |
BrClNO2C12H15 |
ABCD2E12F15 |
-89.36 |
4.62 |
-9.95 |
-0.99 |
0 |
|
|
277193 |
103827244 |
1 |
O2N3C14H15 |
A2B3C14D15 |
-50.83 |
6.68 |
-8.67 |
-0.7 |
0 |
|
|
277194 |
103827249 |
1 |
BrClNO2H9C13 |
ABCD2E9F13 |
-40.25 |
3.8 |
-8.86 |
-1.02 |
0 |
|
|
277195 |
103827252 |
1 |
N2O3H14C15 |
A2B3C14D15 |
-88.93 |
4.79 |
-9.01 |
-0.36 |
0 |
|
|
277196 |
103827258 |
1 |
BrClON3H7C10 |
ABCD3E7F10 |
15.06 |
1.34 |
-9.1 |
-1.36 |
0 |
|
|
277197 |
103827262 |
1 |
BrClNO2H11C14 |
ABCD2E11F14 |
-49.32 |
2.65 |
-8.7 |
-1.08 |
0 |
|
|
277198 |
103827268 |
1 |
ON2C17H24 |
AB2C17D24 |
-12.13 |
5.13 |
-8.64 |
-0.36 |
0 |
|
|
277199 |
103827269 |
1 |
SN2O2C14H18 |
AB2C2D14E18 |
-64.6 |
3.18 |
-8.72 |
-0.24 |
0 |