List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
22201 |
596247 |
2 |
NOC4H4 |
ABC4D4 |
29.92 |
6.17 |
-9.16 |
-1.2 |
0 |
|
|
22202 |
596258 |
1 |
N2O3C17H18 |
A2B3C17D18 |
-14.62 |
6.03 |
-9.58 |
-1.42 |
0 |
|
|
22203 |
596276 |
1 |
BrSN2Cl3O7C12H12 |
ABC2D3E7F12G12 |
-266.42 |
1.91 |
-9.93 |
-1.62 |
0 |
|
|
22204 |
596277 |
1 |
NCl2O5H15C17 |
AB2C5D15E17 |
-182.16 |
6.3 |
-9.25 |
-0.95 |
0 |
|
|
22205 |
596280 |
1 |
FON2H5C8 |
ABC2D5E8 |
1.47 |
2.11 |
-10.2 |
-0.81 |
0 |
|
|
22206 |
596282 |
2 |
NC5H8 |
AB5C8 |
4.51 |
3.88 |
-8.44 |
1.22 |
0 |
|
|
22207 |
596283 |
2 |
NOC4H4 |
ABC4D4 |
-66.6 |
9.35 |
-9.46 |
-0.91 |
0 |
|
|
22208 |
596284 |
1 |
ON4C7H8 |
AB4C7D8 |
66.85 |
2.09 |
-9.62 |
-0.74 |
0 |
|
|
22210 |
596289 |
1 |
SC10H12 |
AB10C12 |
13.96 |
2.12 |
-8.55 |
0.18 |
0 |
|
|
22211 |
596290 |
1 |
N2O3C10H12 |
A2B3C10D12 |
-29.75 |
6.35 |
-9.98 |
-1.34 |
0 |
|
|
22212 |
596292 |
1 |
BrFN2O3H10C14 |
ABC2D3E10F14 |
-46.67 |
2.6 |
-9.44 |
-1.84 |
0 |
|
|
22213 |
596304 |
1 |
NO3C17H19 |
AB3C17D19 |
-69.87 |
3.16 |
-8.62 |
-0.67 |
0 |
|
|
22214 |
596306 |
1 |
ON2C9H12 |
AB2C9D12 |
-23.88 |
3.98 |
-9.74 |
-0.9 |
0 |
|
|
22215 |
596307 |
1 |
SO2N3H13C15 |
AB2C3D13E15 |
-16.05 |
5.51 |
-8.76 |
-0.76 |
0 |
|
|
22216 |
596308 |
1 |
ClNS2H14C15 |
ABC2D14E15 |
55.38 |
1.85 |
-8.92 |
-0.58 |
0 |
|
|
22217 |
596314 |
1 |
ClNOH8C10 |
ABCD8E10 |
-6.54 |
3.8 |
-9.51 |
-1.17 |
0 |
|
|
22218 |
596316 |
1 |
ClOSN3H14C16 |
ABCD3E14F16 |
12.62 |
8.13 |
-8.75 |
-0.98 |
0 |
|
|
22219 |
596317 |
1 |
OSF3N3H12C16 |
ABC3D3E12F16 |
-126.17 |
1.77 |
-8.99 |
-0.92 |
0 |
|
|
22220 |
596318 |
1 |
SN2C14H18 |
AB2C14D18 |
31.73 |
3.16 |
-8.37 |
-0.12 |
0 |
|
|
22221 |
596324 |
1 |
OSiC11H16 |
ABC11D16 |
-41.69 |
1.67 |
-8.61 |
0.38 |
0 |
|
|
22222 |
596329 |
1 |
NO4C18H21 |
AB4C18D21 |
-114.53 |
1.58 |
-8.32 |
-0.37 |
0 |
|
|
22223 |
596330 |
1 |
ON2C9H12 |
AB2C9D12 |
-30.54 |
3.19 |
-9.07 |
-0.12 |
0 |
|
|
22224 |
596331 |
1 |
BrN2O2C21H25 |
AB2C2D21E25 |
-81.37 |
5.5 |
-9.24 |
-0.44 |
0 |
|
|
22225 |
596333 |
2 |
NC6H10 |
AB6C10 |
-9.12 |
0.01 |
-9.15 |
-0.06 |
0 |
|
|
22226 |
596334 |
1 |
ON2F6C16H22 |
AB2C6D16E22 |
-389.63 |
6.04 |
-10.18 |
0.38 |
0 |
|
|
22227 |
596335 |
2 |
OH2N2C3 |
AB2C2D3 |
-13.28 |
7.87 |
-9.88 |
-1.38 |
0 |
|
|
22228 |
596336 |
1 |
SN3C10H13 |
AB3C10D13 |
62.28 |
3.55 |
-8.53 |
-0.27 |
0 |
|
|
22229 |
596337 |
1 |
N3S4C13H15 |
A3B4C13D15 |
111.11 |
8.49 |
-8.75 |
-0.95 |
0 |
|
|
22230 |
596347 |
1 |
O3N5C16H21 |
A3B5C16D21 |
-56.27 |
3.16 |
-8.71 |
0.0 |
0 |
|
|
22231 |
596348 |
1 |
O3N4C8H10 |
A3B4C8D10 |
-69.09 |
9.36 |
-9.35 |
-0.9 |
0 |
|
|
22232 |
596350 |
1 |
N5C18H19 |
A5B18C19 |
77.95 |
3.19 |
-8.61 |
-0.22 |
0 |
|
|
22233 |
596353 |
2 |
NO2C5H6 |
AB2C5D6 |
-153.2 |
3.14 |
-8.56 |
0.0 |
0 |
|
|
22234 |
596355 |
1 |
O5H16C17 |
A5B16C17 |
-149.63 |
3.34 |
-8.37 |
-0.48 |
0 |
|
|
22235 |
596356 |
1 |
BrN3O4C10H10 |
AB3C4D10E10 |
-79.11 |
7.7 |
-9.89 |
-1.46 |
0 |
|
|
22236 |
596357 |
1 |
ClO3N6H13C14 |
AB3C6D13E14 |
9.71 |
6.02 |
-9.26 |
-1.9 |
0 |
|
|
22237 |
596358 |
1 |
OS2N3H15C16 |
AB2C3D15E16 |
34.1 |
4.98 |
-8.79 |
-0.73 |
0 |
|
|
22238 |
596359 |
1 |
ClO2F3C20H20 |
AB2C3D20E20 |
-236.38 |
4.82 |
-10.15 |
-1.27 |
0 |
|
|
22239 |
596360 |
1 |
O5C21H30 |
A5B21C30 |
-246.07 |
2.3 |
-9.87 |
0.54 |
0 |
|
|
22240 |
596362 |
1 |
NO2C17H27 |
AB2C17D27 |
-73.72 |
1.29 |
-8.81 |
-0.19 |
0 |
|
|
22241 |
596368 |
1 |
ON5C19H23 |
AB5C19D23 |
57.06 |
5.88 |
-8.61 |
-0.47 |
0 |
|
|
22242 |
596373 |
2 |
OC5H6 |
AB5C6 |
-46.94 |
1.86 |
-8.51 |
0.11 |
0 |
|
|
22243 |
596385 |
1 |
SN2O2H10C11 |
AB2C2D10E11 |
-11.32 |
3.99 |
-8.82 |
-0.78 |
0 |
|
|
22244 |
596386 |
1 |
NSO3H9C11 |
ABC3D9E11 |
-45.46 |
6.82 |
-9.35 |
-1.56 |
0 |
|
|
22245 |
596387 |
2 |
O2C9H10 |
A2B9C10 |
-118.3 |
4.52 |
-8.18 |
0.22 |
0 |
|
|
22246 |
596388 |
1 |
SN2O2H18C19 |
AB2C2D18E19 |
-6.3 |
3.95 |
-8.93 |
-0.89 |
0 |
|
|
22247 |
596389 |
1 |
NO5C20H23 |
AB5C20D23 |
-159.44 |
7.0 |
-8.43 |
0.02 |
0 |
|
|
22248 |
596412 |
1 |
H4F8C9 |
A4B8C9 |
-350.39 |
3.71 |
-11.09 |
-0.82 |
0 |
|
|
22249 |
596413 |
1 |
OSN2C16H16 |
ABC2D16E16 |
26.48 |
1.55 |
-8.41 |
-0.3 |
0 |
|
|
22250 |
596414 |
1 |
SN3O3H13C16 |
AB3C3D13E16 |
30.35 |
10.21 |
-9.42 |
-1.35 |
0 |
|
|
22251 |
596415 |
1 |
N2O6H16C17 |
A2B6C16D17 |
-65.2 |
4.19 |
-8.56 |
-1.84 |
0 |