List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
4205 |
10963 |
1 |
ClNC3H4 |
ABC3D4 |
10.71 |
1.69 |
-11.16 |
0.2 |
0 |
|
|
4206 |
10964 |
1 |
O2C3H4 |
A2B3C4 |
-62.99 |
3.2 |
-10.32 |
-0.17 |
0 |
|
|
4207 |
10966 |
1 |
NSC3H5 |
ABC3D5 |
26.25 |
4.64 |
-8.95 |
-0.12 |
0 |
|
|
4208 |
10968 |
1 |
NSC3H5 |
ABC3D5 |
27.14 |
4.19 |
-9.46 |
-0.4 |
0 |
|
|
4209 |
10969 |
1 |
ClNOC8H20 |
ABCD8E20 |
-129.73 |
4.57 |
-10.34 |
2.12 |
0 |
|
|
4210 |
10970 |
2 |
ClOC2H2 |
ABC2D2 |
-104.69 |
3.73 |
-11.55 |
-0.68 |
0 |
|
|
4211 |
10971 |
2 |
NOC2H2 |
ABC2D2 |
-23.14 |
1.16 |
-10.97 |
-0.92 |
0 |
|
|
4212 |
10972 |
1 |
NO3C4H7 |
AB3C4D7 |
-140.26 |
6.31 |
-10.4 |
0.21 |
0 |
|
|
4213 |
10973 |
1 |
NO2C5H11 |
AB2C5D11 |
-111.2 |
2.28 |
-10.64 |
0.86 |
0 |
|
|
4214 |
10974 |
1 |
NO3C4H9 |
AB3C4D9 |
-54.8 |
3.62 |
-11.62 |
-0.91 |
0 |
|
|
4215 |
10975 |
1 |
OC10H18 |
AB10C18 |
-51.98 |
1.94 |
-9.5 |
0.62 |
0 |
|
|
4216 |
10976 |
1 |
OC7H16 |
AB7C16 |
-84.07 |
1.95 |
-10.35 |
2.87 |
0 |
|
|
4217 |
10977 |
1 |
ClC5H11 |
AB5C11 |
-38.87 |
2.42 |
-10.61 |
0.89 |
0 |
|
|
4219 |
10988 |
1 |
NC10H23 |
AB10C23 |
-44.85 |
1.41 |
-8.76 |
3.12 |
0 |
|
|
4220 |
10989 |
1 |
OC10H22 |
AB10C22 |
-89.85 |
1.33 |
-9.53 |
2.34 |
0 |
|
|
4221 |
10990 |
1 |
SC10H22 |
AB10C22 |
-49.87 |
1.81 |
-8.42 |
0.92 |
0 |
|
|
4222 |
10991 |
1 |
NO3H5C8 |
AB3C5D8 |
0.23 |
3.33 |
-10.73 |
-1.78 |
0 |
|
|
4223 |
10993 |
1 |
OC6H12 |
AB6C12 |
-53.75 |
2.28 |
-9.82 |
1.06 |
0 |
|
|
4224 |
10998 |
1 |
CoC2H2O4 |
AB2C2D4 |
-167.04 |
2.44 |
0.0 |
0.0 |
0 |
|
|
4225 |
10999 |
1 |
CuC2H2O4 |
AB2C2D4 |
-128.94 |
6.19 |
0.0 |
0.0 |
0 |
|
|
4226 |
11004 |
1 |
NO2H5C8 |
AB2C5D8 |
76.29 |
4.26 |
-10.33 |
-1.13 |
0 |
|
|
4227 |
11006 |
2 |
C8H17 |
A8B17 |
-81.63 |
0.06 |
-10.67 |
3.98 |
0 |
|
|
4228 |
11007 |
1 |
IC16H33 |
AB16C33 |
-64.12 |
1.79 |
-9.56 |
-0.69 |
0 |
|
|
4229 |
11008 |
2 |
C16H33 |
A16B33 |
-155.09 |
0.07 |
-10.46 |
4.01 |
0 |
|
|
4230 |
11009 |
1 |
CCuN |
ABC |
101.48 |
5.65 |
-9.54 |
0.96 |
0 |