List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
69151 |
46525582 |
1 |
SO3N4H22C25 |
AB3C4D22E25 |
-6.76 |
4.36 |
-8.82 |
-0.84 |
0 |
|
|
69152 |
46525587 |
1 |
SO2N4C20H22 |
AB2C4D20E22 |
-8.24 |
2.37 |
-8.72 |
-0.89 |
0 |
|
|
69153 |
46525588 |
1 |
SO3N5H17C20 |
AB3C5D17E20 |
36.59 |
2.82 |
-8.76 |
-1.09 |
0 |
|
|
69154 |
46525616 |
1 |
SO3N4H22C24 |
AB3C4D22E24 |
-37.51 |
6.3 |
-8.49 |
-1.68 |
0 |
|
|
69155 |
46525618 |
1 |
OSN5C18H21 |
ABC5D18E21 |
21.64 |
2.21 |
-9.03 |
-0.71 |
0 |
|
|
69156 |
46525634 |
1 |
SO2N5C19H21 |
AB2C5D19E21 |
-24.43 |
6.43 |
-9.12 |
-1.04 |
0 |
|
|
69157 |
46525637 |
1 |
SN5O5C19H21 |
AB5C5D19E21 |
-75.87 |
6.59 |
-9.16 |
-1.79 |
0 |
|
|
69158 |
46525642 |
1 |
SO3N4C18H22 |
AB3C4D18E22 |
-83.31 |
5.83 |
-8.78 |
-0.75 |
0 |
|
|
69159 |
46525658 |
1 |
FOSN6H17C18 |
ABCD6E17F18 |
46.57 |
2.32 |
-8.73 |
-0.94 |
0 |
|
|
69160 |
46525663 |
1 |
SO2F3N5H18C20 |
AB2C3D5E18F20 |
-138.32 |
4.57 |
-8.92 |
-1.23 |
0 |
|
|
69161 |
46525687 |
1 |
F3N3O4C19H22 |
A3B3C4D19E22 |
-330.62 |
5.58 |
-9.65 |
-0.36 |
0 |
|
|
69162 |
46525691 |
1 |
BrClN3O3C21H21 |
ABC3D3E21F21 |
-97.78 |
5.62 |
-9.52 |
-0.76 |
0 |
|
|
69163 |
46525701 |
1 |
SO2N5C25H25 |
AB2C5D25E25 |
51.16 |
2.25 |
-9.3 |
-1.36 |
0 |
|
|
69164 |
46525711 |
3 |
NOC8H9 |
ABC8D9 |
-83.24 |
6.27 |
-9.12 |
-0.33 |
0 |
|
|
69165 |
46525714 |
1 |
SO3N5C26H33 |
AB3C5D26E33 |
-75.51 |
8.91 |
-8.5 |
-0.69 |
0 |
|
|
69166 |
46525718 |
3 |
NOC8H9 |
ABC8D9 |
-77.78 |
5.37 |
-9.19 |
-0.39 |
0 |
|
|
69167 |
46525726 |
1 |
N4O4C27H32 |
A4B4C27D32 |
-143.38 |
4.78 |
-8.88 |
-0.52 |
0 |
|
|
69168 |
46525731 |
1 |
O3N5C24H25 |
A3B5C24D25 |
-43.88 |
3.06 |
-9.34 |
-0.26 |
0 |
|
|
69169 |
46525734 |
1 |
SO3N6H22C23 |
AB3C6D22E23 |
5.88 |
3.68 |
-8.78 |
-0.97 |
0 |
|
|
69170 |
46530153 |
1 |
S2N4O4H20C23 |
A2B4C4D20E23 |
-22.33 |
6.48 |
-8.64 |
-1.26 |
0 |
|
|
69171 |
46530284 |
1 |
SO3N5C22H29 |
AB3C5D22E29 |
-89.6 |
4.14 |
-9.1 |
-0.92 |
0 |
|
|
69172 |
46530285 |
1 |
SO3N6H18C19 |
AB3C6D18E19 |
5.82 |
6.15 |
-9.3 |
-0.93 |
0 |
|
|
69173 |
46530292 |
1 |
SN2O5H22C23 |
AB2C5D22E23 |
-131.26 |
3.91 |
-8.86 |
-1.14 |
0 |
|
|
69174 |
46530293 |
1 |
BrNO3C21H26 |
ABC3D21E26 |
-154.24 |
6.97 |
-9.14 |
-0.63 |
0 |
|
|
69175 |
46530296 |
3 |
FNOH6C7 |
ABCD6E7 |
-209.9 |
4.86 |
-9.08 |
-1.32 |
0 |
|
|
69176 |
46530308 |
1 |
SO3N4H22C23 |
AB3C4D22E23 |
-21.6 |
5.45 |
-9.2 |
-1.34 |
0 |
|
|
69177 |
46530318 |
1 |
BrNO4C17H22 |
ABC4D17E22 |
-162.19 |
3.78 |
-9.46 |
-0.76 |
0 |
|
|
69178 |
46530328 |
1 |
ClN2O3C21H21 |
AB2C3D21E21 |
-103.01 |
7.71 |
-9.47 |
-1.36 |
0 |
|
|
69179 |
46530329 |
2 |
N2O2C11H13 |
A2B2C11D13 |
-140.2 |
6.6 |
-8.1 |
0.03 |
0 |
|
|
69180 |
46530341 |
1 |
O3N5H23C27 |
A3B5C23D27 |
63.73 |
7.26 |
-8.71 |
-0.75 |
0 |
|
|
69181 |
46530357 |
1 |
ClNO6H24C27 |
ABC6D24E27 |
-169.29 |
3.81 |
-9.21 |
-1.06 |
0 |
|
|
69182 |
46530360 |
1 |
N2O5H20C23 |
A2B5C20D23 |
-74.87 |
5.64 |
-8.82 |
-1.1 |
0 |
|
|
69183 |
46530363 |
1 |
FSN3O5H18C24 |
ABC3D5E18F24 |
-84.43 |
5.47 |
-9.09 |
-1.29 |
0 |
|
|
69184 |
46530366 |
1 |
BrFSN2O3H18C20 |
ABCD2E3F18G20 |
-117.81 |
4.41 |
-8.95 |
-1.71 |
0 |
|
|
69185 |
46530368 |
1 |
NO6C24H25 |
AB6C24D25 |
-193.98 |
1.64 |
-9.15 |
-1.03 |
0 |
|
|
69186 |
46530380 |
1 |
N4O5H20C24 |
A4B5C20D24 |
-73.7 |
3.01 |
-9.01 |
-0.98 |
0 |
|
|
69187 |
46530384 |
1 |
O2N5H19C23 |
A2B5C19D23 |
69.79 |
7.04 |
-9.13 |
-1.03 |
0 |
|
|
69188 |
46530385 |
1 |
N3O3C27H29 |
A3B3C27D29 |
-62.18 |
2.6 |
-8.82 |
-0.66 |
0 |
|
|
69189 |
46530389 |
1 |
N2O5H24C26 |
A2B5C24D26 |
-143.07 |
10.74 |
-9.05 |
-1.07 |
0 |
|
|
69190 |
46530390 |
1 |
BrN3O3H18C23 |
AB3C3D18E23 |
-29.85 |
3.31 |
-8.23 |
-1.26 |
0 |
|
|
69191 |
46530392 |
1 |
BrN2O3H23C25 |
AB2C3D23E25 |
-48.33 |
7.34 |
-9.11 |
-1.07 |
0 |
|
|
69192 |
46530394 |
1 |
N2O3C27H28 |
A2B3C27D28 |
-72.38 |
6.15 |
-8.84 |
-0.95 |
0 |
|
|
69193 |
46530395 |
2 |
NOH12C14 |
ABC12D14 |
18.59 |
2.36 |
-8.35 |
-0.51 |
0 |
|
|
69194 |
46530397 |
4 |
NOC7H7 |
ABC7D7 |
-64.09 |
6.52 |
-8.07 |
-0.08 |
0 |
|
|
69195 |
46530402 |
1 |
ON3F4H17C24 |
AB3C4D17E24 |
-129.7 |
5.48 |
-9.09 |
-0.92 |
0 |
|
|
69196 |
46530404 |
1 |
BrN2O2C24H33 |
AB2C2D24E33 |
-106.93 |
2.53 |
-8.76 |
0.08 |
0 |
|
|
69197 |
46530407 |
1 |
FN2O4C22H23 |
AB2C4D22E23 |
-168.58 |
6.67 |
-8.95 |
-1.43 |
0 |
|
|
69198 |
46530411 |
1 |
N2O3H24C25 |
A2B3C24D25 |
-58.15 |
9.27 |
-8.9 |
-0.95 |
0 |
|
|
69199 |
46530426 |
1 |
N2O7C24H26 |
A2B7C24D26 |
-247.17 |
5.42 |
-8.54 |
-1.36 |
0 |
|
|
69200 |
46530435 |
1 |
N3O3H19C23 |
A3B3C19D23 |
-17.51 |
5.73 |
-8.65 |
-1.04 |
0 |
|
|
69201 |
46530436 |
1 |
N4O4C25H30 |
A4B4C25D30 |
-96.73 |
3.21 |
-8.68 |
-0.66 |
0 |
|
|
69202 |
46530446 |
1 |
ClN3O3C21H24 |
AB3C3D21E24 |
-124.18 |
6.52 |
-9.0 |
-0.32 |
0 |
|
|
69203 |
46530447 |
1 |
O4N5C16H17 |
A4B5C16D17 |
-49.65 |
5.13 |
-8.49 |
-1.02 |
0 |
|
|
69204 |
46530450 |
1 |
O4N5C24H25 |
A4B5C24D25 |
-118.79 |
4.91 |
-8.97 |
-0.49 |
0 |
|
|
69205 |
46530451 |
1 |
N3O3C24H25 |
A3B3C24D25 |
-52.06 |
2.85 |
-9.1 |
-1.1 |
0 |
|
|
69206 |
46530453 |
1 |
BrN2O3H19C23 |
AB2C3D19E23 |
-46.93 |
8.78 |
-8.98 |
-0.91 |
0 |
|
|
69207 |
46530454 |
1 |
O3N4C21H22 |
A3B4C21D22 |
-54.56 |
6.01 |
-8.75 |
-0.58 |
0 |
|
|
69208 |
46530455 |
1 |
O2N5H27C30 |
A2B5C27D30 |
81.37 |
3.5 |
-8.77 |
-0.88 |
0 |
|
|
69209 |
46530457 |
2 |
N2O2C11H13 |
A2B2C11D13 |
-113.12 |
4.89 |
-8.9 |
0.07 |
0 |
|
|
69210 |
46530459 |
1 |
BrNO3C24H32 |
ABC3D24E32 |
-142.41 |
7.68 |
-8.59 |
-0.14 |
0 |
|
|
69211 |
46530460 |
1 |
SN3O4C25H31 |
AB3C4D25E31 |
-122.77 |
4.21 |
-9.23 |
-0.75 |
0 |
|
|
69212 |
46530461 |
1 |
SN2O4C23H30 |
AB2C4D23E30 |
-142.26 |
4.55 |
-9.3 |
-1.09 |
0 |
|
|
69213 |
46530462 |
1 |
BrON3C23H28 |
ABC3D23E28 |
-30.21 |
2.75 |
-9.2 |
0.04 |
0 |
|
|
69214 |
46530463 |
1 |
O2N6H26C29 |
A2B6C26D29 |
92.75 |
5.36 |
-8.74 |
-0.89 |
0 |
|
|
69215 |
46530465 |
1 |
FO2N4C25H25 |
AB2C4D25E25 |
-42.12 |
3.92 |
-8.65 |
-0.66 |
0 |
|
|
69216 |
46530466 |
1 |
O2N6C25H30 |
A2B6C25D30 |
14.08 |
2.3 |
-8.88 |
-0.68 |
0 |
|
|
69217 |
46530467 |
1 |
N2O2C19H24 |
A2B2C19D24 |
-75.84 |
1.86 |
-9.24 |
0.06 |
0 |
|
|
69218 |
46530469 |
1 |
FN3O3H20C25 |
AB3C3D20E25 |
-47.42 |
3.92 |
-8.87 |
-0.88 |
0 |
|
|
69219 |
46530471 |
1 |
N3O3C23H23 |
A3B3C23D23 |
-62.04 |
5.32 |
-9.41 |
-0.51 |
0 |
|
|
69220 |
46530472 |
1 |
O2N5H21C25 |
A2B5C21D25 |
48.81 |
4.49 |
-8.24 |
-0.92 |
0 |
|
|
69221 |
46530473 |
1 |
FO2N5H20C25 |
AB2C5D20E25 |
0.64 |
9.61 |
-8.29 |
-1.0 |
0 |
|
|
69222 |
46530474 |
2 |
ON2C9H9 |
AB2C9D9 |
-38.71 |
8.09 |
-8.22 |
-0.3 |
0 |
|
|
69223 |
46530475 |
2 |
N2O2C11H14 |
A2B2C11D14 |
-166.39 |
5.56 |
-8.84 |
-0.49 |
0 |
|
|
69224 |
46530476 |
1 |
ON3C23H25 |
AB3C23D25 |
32.83 |
5.36 |
-9.15 |
-0.5 |
0 |
|
|
69225 |
46530477 |
1 |
OCl2N3C23H23 |
AB2C3D23E23 |
23.79 |
4.75 |
-9.45 |
-0.5 |
0 |
|
|
69226 |
46530479 |
2 |
NO2C13H14 |
AB2C13D14 |
-35.62 |
3.99 |
-8.53 |
-0.43 |
0 |
|
|
69227 |
46530480 |
1 |
ClO2N5H18C19 |
AB2C5D18E19 |
-8.07 |
7.41 |
-8.28 |
-0.44 |
0 |
|
|
69228 |
46530481 |
1 |
FO2N5H18C19 |
AB2C5D18E19 |
-55.39 |
7.28 |
-8.32 |
-0.83 |
0 |
|
|
69229 |
46530483 |
1 |
O2N3C18H23 |
A2B3C18D23 |
-92.34 |
6.52 |
-8.28 |
0.05 |
0 |
|
|
69230 |
46530484 |
1 |
O2N5H23C26 |
A2B5C23D26 |
43.65 |
4.95 |
-8.17 |
-0.51 |
0 |
|
|
69231 |
46530485 |
1 |
O2F3N3H12C15 |
A2B3C3D12E15 |
-193.74 |
8.11 |
-8.5 |
-0.99 |
0 |
|
|
69232 |
46530489 |
1 |
ClO2N5C20H20 |
AB2C5D20E20 |
-8.54 |
1.68 |
-8.2 |
-0.42 |
0 |
|
|
69233 |
46530491 |
1 |
FO2N5C20H20 |
AB2C5D20E20 |
-54.73 |
7.06 |
-8.27 |
-0.82 |
0 |
|
|
69234 |
46530494 |
1 |
O2N6C25H26 |
A2B6C25D26 |
13.63 |
6.13 |
-8.38 |
-0.96 |
0 |
|
|
69235 |
46530495 |
1 |
ClO2N5C14H16 |
AB2C5D14E16 |
-33.58 |
6.93 |
-8.22 |
-0.36 |
0 |
|
|
69236 |
46530496 |
1 |
N4O4C25H28 |
A4B4C25D28 |
-137.59 |
5.58 |
-8.8 |
-1.48 |
0 |
|
|
69237 |
46530500 |
1 |
N2O5H26C28 |
A2B5C26D28 |
-117.83 |
3.43 |
-8.37 |
-1.59 |
0 |
|
|
69238 |
46530501 |
1 |
BrF2N2O3H17C20 |
AB2C2D3E17F20 |
-161.69 |
6.68 |
-9.69 |
-1.78 |
0 |
|
|
69239 |
46530504 |
2 |
NO2C12H14 |
AB2C12D14 |
-143.41 |
5.19 |
-9.35 |
-0.71 |
0 |
|
|
69240 |
46530506 |
1 |
SN2F3O3C20H21 |
AB2C3D3E20F21 |
-234.75 |
8.12 |
-8.93 |
-0.82 |
0 |
|
|
69241 |
46530509 |
1 |
O2N6H24C29 |
A2B6C24D29 |
109.35 |
3.87 |
-9.29 |
-0.93 |
0 |
|
|
69242 |
46530511 |
1 |
BrN2O4H17C25 |
AB2C4D17E25 |
-44.2 |
6.3 |
-8.96 |
-0.97 |
0 |
|
|
69243 |
46530516 |
1 |
N3O4H23C26 |
A3B4C23D26 |
-42.11 |
1.01 |
-8.79 |
-0.78 |
0 |
|
|
69244 |
46530517 |
1 |
SO3N4C20H22 |
AB3C4D20E22 |
-85.63 |
9.44 |
-8.64 |
-0.82 |
0 |
|
|
69245 |
46530519 |
1 |
N3O3C21H23 |
A3B3C21D23 |
9.84 |
5.7 |
-8.98 |
-0.92 |
0 |
|
|
69246 |
46530520 |
1 |
O2S2N4H18C19 |
A2B2C4D18E19 |
-9.89 |
5.38 |
-8.49 |
-1.03 |
0 |
|
|
69247 |
46530521 |
1 |
SO2N3H19C21 |
AB2C3D19E21 |
-11.9 |
5.67 |
-8.41 |
-0.49 |
0 |
|
|
69248 |
46530522 |
1 |
O2N6H22C25 |
A2B6C22D25 |
59.84 |
8.71 |
-8.27 |
-1.03 |
0 |
|
|
69249 |
46530523 |
1 |
SN4O4C23H28 |
AB4C4D23E28 |
-109.4 |
7.23 |
-8.42 |
-1.12 |
0 |
|
|
69250 |
46530524 |
1 |
N4O5H22C25 |
A4B5C22D25 |
-119.36 |
5.63 |
-8.1 |
-1.4 |
0 |