List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
281200 |
103911387 |
1 |
BrNO2C14H20 |
ABC2D14E20 |
-80.91 |
2.57 |
-9.34 |
-0.26 |
0 |
|
|
281201 |
103911389 |
1 |
ClNO3C14H18 |
ABC3D14E18 |
-106.43 |
3.83 |
-8.93 |
-0.41 |
0 |
|
|
281202 |
103911390 |
1 |
FNOC9H18 |
ABCD9E18 |
-119.87 |
1.74 |
-9.13 |
2.32 |
0 |
|
|
281203 |
103911428 |
1 |
ON2C17H28 |
AB2C17D28 |
-29.59 |
3.25 |
-8.7 |
0.33 |
0 |
|
|
281204 |
103911440 |
1 |
SN3O3C14H25 |
AB3C3D14E25 |
-116.41 |
6.58 |
-8.96 |
-0.5 |
0 |
|
|
281205 |
103911443 |
1 |
NOC13H23 |
ABC13D23 |
-60.31 |
2.86 |
-9.02 |
1.43 |
0 |
|
|
281206 |
103911449 |
1 |
FNOC17H26 |
ABCD17E26 |
-78.18 |
4.26 |
-9.18 |
-0.04 |
0 |
|
|
281207 |
103911456 |
1 |
N2O3C16H32 |
A2B3C16D32 |
-188.32 |
3.16 |
-8.86 |
0.75 |
0 |
|
|
281208 |
103911457 |
1 |
ClNOSC13H20 |
ABCDE13F20 |
-35.83 |
0.75 |
-8.43 |
0.05 |
0 |
|
|
281209 |
103911472 |
1 |
NOSC14H21 |
ABCD14E21 |
10.82 |
2.01 |
-9.04 |
-0.06 |
0 |
|
|
281210 |
103911478 |
1 |
NOC16H23 |
ABC16D23 |
9.15 |
1.03 |
-9.14 |
0.31 |
0 |
|
|
281211 |
103911480 |
1 |
ClNOC15H22 |
ABCD15E22 |
-32.84 |
3.0 |
-9.06 |
0.18 |
0 |
|
|
281212 |
103911481 |
1 |
SN2O3C14H22 |
AB2C3D14E22 |
-90.98 |
5.41 |
-9.26 |
-0.5 |
0 |
|
|
281213 |
103911486 |
1 |
ClN3C14H18 |
AB3C14D18 |
37.21 |
2.24 |
-9.03 |
0.13 |
0 |
|
|
281214 |
103911494 |
1 |
NO2C17H27 |
AB2C17D27 |
-71.37 |
1.71 |
-8.64 |
0.35 |
0 |
|
|
281215 |
103911505 |
1 |
NO2C13H23 |
AB2C13D23 |
-91.75 |
1.54 |
-9.29 |
1.84 |
0 |
|
|
281216 |
103911507 |
1 |
ON3C17H23 |
AB3C17D23 |
11.69 |
2.54 |
-8.79 |
-0.07 |
0 |
|
|
281217 |
103911515 |
1 |
NO2C16H25 |
AB2C16D25 |
-69.33 |
1.39 |
-8.93 |
0.36 |
0 |
|
|
281218 |
103911519 |
1 |
NO3C11H23 |
AB3C11D23 |
-158.06 |
3.02 |
-8.98 |
1.66 |
0 |
|
|
281219 |
103911520 |
1 |
ClNO2C15H22 |
ABC2D15E22 |
-68.83 |
4.0 |
-9.48 |
-0.2 |
0 |
|
|
281220 |
103911522 |
1 |
NO2C15H23 |
AB2C15D23 |
-58.56 |
3.15 |
-9.37 |
0.21 |
0 |
|
|
281221 |
103911523 |
1 |
O2N3C15H23 |
A2B3C15D23 |
-56.48 |
4.07 |
-8.72 |
0.01 |
0 |
|
|
281222 |
103911525 |
1 |
SN2O4C13H22 |
AB2C4D13E22 |
-154.12 |
3.82 |
-9.29 |
-0.5 |
0 |
|
|
281223 |
103911528 |
2 |
NO2C8H16 |
AB2C8D16 |
-217.17 |
6.06 |
-8.92 |
0.89 |
0 |
|
|
281224 |
103911529 |
1 |
NO2C13H25 |
AB2C13D25 |
-127.75 |
1.4 |
-9.0 |
2.29 |
0 |
|
|
281225 |
103911530 |
1 |
BrNOC13H18 |
ABCD13E18 |
-12.98 |
2.31 |
-9.33 |
-0.18 |
0 |
|
|
281226 |
103911534 |
1 |
OCl2N2C11H16 |
AB2C2D11E16 |
-58.19 |
2.36 |
-8.68 |
-0.34 |
0 |
|
|
281227 |
103911535 |
1 |
NO2C9H19 |
AB2C9D19 |
-118.26 |
3.25 |
-9.03 |
2.41 |
0 |
|
|
281228 |
103911536 |
1 |
NOC13H21 |
ABC13D21 |
-48.32 |
1.53 |
-9.13 |
0.39 |
0 |
|
|
281229 |
103911539 |
1 |
ClNOC13H20 |
ABCD13E20 |
-57.45 |
2.01 |
-9.24 |
-0.03 |
0 |
|
|
281230 |
103911540 |
1 |
BrNOC12H16 |
ABCD12E16 |
-33.04 |
0.89 |
-9.23 |
-0.04 |
0 |
|
|
281231 |
103911551 |
1 |
NOC13H19 |
ABC13D19 |
-13.42 |
1.46 |
-9.21 |
0.24 |
0 |
|
|
281232 |
103911555 |
1 |
NOC14H21 |
ABC14D21 |
-26.78 |
2.83 |
-9.22 |
0.19 |
0 |
|
|
281233 |
103911557 |
1 |
FN4C14H17 |
AB4C14D17 |
44.12 |
4.26 |
-9.15 |
0.03 |
0 |
|
|
281234 |
103911561 |
1 |
ON4C10H18 |
AB4C10D18 |
-7.06 |
5.55 |
-8.96 |
0.22 |
0 |
|
|
281235 |
103911563 |
2 |
N2C7H10 |
A2B7C10 |
61.59 |
3.87 |
-8.85 |
0.32 |
0 |
|
|
281236 |
103911565 |
1 |
SO2N5C12H17 |
AB2C5D12E17 |
-5.27 |
4.81 |
-9.21 |
-0.49 |
0 |
|
|
281237 |
103911570 |
1 |
NO3C14H25 |
AB3C14D25 |
-157.36 |
3.04 |
-9.17 |
2.03 |
0 |
|
|
281238 |
103911572 |
1 |
O2N6C11H16 |
A2B6C11D16 |
53.21 |
11.24 |
-9.28 |
-0.8 |
0 |
|
|
281239 |
103911575 |
1 |
ClO2N5C11H12 |
AB2C5D11E12 |
53.95 |
4.23 |
-9.56 |
-1.8 |
0 |
|
|
281240 |
103911576 |
1 |
FO3N4C13H15 |
AB3C4D13E15 |
-36.49 |
6.6 |
-9.33 |
-1.08 |
0 |
|
|
281241 |
103911627 |
1 |
ClON3C10H14 |
ABC3D10E14 |
-25.84 |
3.3 |
-9.42 |
-0.48 |
0 |
|
|
281242 |
103911631 |
4 |
FNC3H3 |
ABC3D3 |
-138.95 |
7.48 |
-9.19 |
-0.74 |
0 |
|
|
281243 |
103913585 |
1 |
NO3C14H21 |
AB3C14D21 |
-118.7 |
1.51 |
-9.22 |
0.16 |
0 |
|
|
281244 |
103913586 |
1 |
N2O2C15H20 |
A2B2C15D20 |
-15.1 |
5.14 |
-9.15 |
0.06 |
0 |
|
|
281245 |
103913587 |
1 |
NO2C17H21 |
AB2C17D21 |
-39.62 |
2.96 |
-9.14 |
0.19 |
0 |
|
|
281246 |
103913588 |
1 |
NOC13H21 |
ABC13D21 |
-34.79 |
0.17 |
-9.03 |
0.3 |
0 |
|
|
281247 |
103913589 |
1 |
ON2C16H26 |
AB2C16D26 |
-26.67 |
2.99 |
-8.77 |
0.29 |
0 |
|
|
281248 |
103913591 |
1 |
NOC18H23 |
ABC18D23 |
-3.75 |
2.23 |
-8.87 |
0.21 |
0 |
|
|
281249 |
103913593 |
1 |
NO3C14H23 |
AB3C14D23 |
-105.99 |
2.24 |
-9.0 |
0.2 |
0 |