List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
353685 |
127285262 |
1 |
SO2N4C13H16 |
AB2C4D13E16 |
-29.67 |
7.81 |
-9.36 |
-0.86 |
0 |
|
|
353686 |
127285263 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-70.75 |
7.48 |
-8.94 |
0.26 |
0 |
|
|
353687 |
127285264 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-103.4 |
4.04 |
-9.25 |
0.86 |
0 |
|
|
353688 |
127285265 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-106.56 |
4.28 |
-9.25 |
0.79 |
0 |
|
|
353689 |
127285266 |
1 |
O2N4C15H26 |
A2B4C15D26 |
-81.94 |
3.84 |
-8.99 |
0.73 |
0 |
|
|
353690 |
127285267 |
3 |
NOC4H7 |
ABC4D7 |
-143.33 |
2.85 |
-9.48 |
0.68 |
0 |
|
|
353691 |
127285268 |
1 |
O2N4C15H18 |
A2B4C15D18 |
-46.64 |
7.34 |
-9.19 |
-0.58 |
0 |
|
|
353692 |
127285269 |
1 |
ON6C8H14 |
AB6C8D14 |
29.98 |
4.17 |
-9.74 |
-0.45 |
0 |
|
|
353693 |
127285270 |
1 |
ON6C10H18 |
AB6C10D18 |
14.76 |
4.49 |
-9.7 |
-0.31 |
0 |
|
|
353694 |
127285271 |
1 |
ON5C15H19 |
AB5C15D19 |
27.52 |
5.81 |
-9.41 |
-0.45 |
0 |
|
|
353695 |
127285272 |
1 |
SO3N4C13H16 |
AB3C4D13E16 |
-79.34 |
7.25 |
-9.63 |
-0.85 |
0 |
|
|
353696 |
127285273 |
1 |
ON5C12H19 |
AB5C12D19 |
14.02 |
5.96 |
-9.42 |
0.07 |
0 |
|
|
353697 |
127285274 |
1 |
N3O3C16H21 |
A3B3C16D21 |
-105.08 |
3.76 |
-8.88 |
0.09 |
0 |
|
|
353698 |
127285275 |
1 |
O2N3C20H29 |
A2B3C20D29 |
-86.53 |
4.77 |
-9.36 |
0.09 |
0 |
|
|
353699 |
127285276 |
1 |
SO2N3C20H23 |
AB2C3D20E23 |
-35.04 |
3.51 |
-9.17 |
-0.28 |
0 |
|
|
353700 |
127285277 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-62.12 |
3.48 |
-9.1 |
0.93 |
0 |
|
|
353701 |
127285278 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-83.34 |
3.28 |
-9.22 |
0.8 |
0 |
|
|
353702 |
127285279 |
1 |
O3N4C20H34 |
A3B4C20D34 |
-131.5 |
3.53 |
-8.9 |
0.41 |
0 |
|
|
353703 |
127285280 |
1 |
ClO2N3C21H30 |
AB2C3D21E30 |
-101.97 |
2.05 |
-9.03 |
-0.04 |
0 |
|
|
353704 |
127285281 |
1 |
ClO2N3C20H26 |
AB2C3D20E26 |
-22.95 |
2.01 |
-9.04 |
-0.23 |
0 |
|
|
353705 |
127285282 |
1 |
F2O2N3C21H29 |
A2B2C3D21E29 |
-181.26 |
2.27 |
-8.8 |
-0.49 |
0 |
|
|
353706 |
127285283 |
1 |
F2O2N3C18H23 |
A2B2C3D18E23 |
-160.89 |
7.56 |
-9.37 |
-0.49 |
0 |
|
|
353707 |
127285284 |
1 |
FON3C21H28 |
ABC3D21E28 |
-61.23 |
6.09 |
-9.54 |
-0.31 |
0 |
|
|
353708 |
127285285 |
1 |
FON3C20H26 |
ABC3D20E26 |
-53.81 |
5.6 |
-9.75 |
-0.29 |
0 |
|
|
353709 |
127285286 |
1 |
FN2O2C18H25 |
AB2C2D18E25 |
-120.65 |
3.48 |
-9.57 |
-0.28 |
0 |
|
|
353710 |
127285287 |
1 |
O2N3C18H33 |
A2B3C18D33 |
-134.1 |
2.01 |
-8.93 |
0.83 |
0 |
|
|
353711 |
127285288 |
1 |
O2N5C19H29 |
A2B5C19D29 |
-40.2 |
4.81 |
-8.73 |
-0.48 |
0 |
|
|
353712 |
127285289 |
1 |
O2N3C22H33 |
A2B3C22D33 |
-99.19 |
3.22 |
-8.88 |
0.06 |
0 |
|
|
353713 |
127285290 |
1 |
SO3N4C18H30 |
AB3C4D18E30 |
-122.69 |
9.8 |
-9.36 |
0.06 |
0 |
|
|
353714 |
127285291 |
1 |
SN2O3C20H36 |
AB2C3D20E36 |
-174.93 |
2.93 |
-8.88 |
0.54 |
0 |
|
|
353715 |
127285292 |
1 |
SN3O3C18H33 |
AB3C3D18E33 |
-156.3 |
4.79 |
-9.02 |
0.66 |
0 |
|
|
353716 |
127285293 |
1 |
NOC13H25 |
ABC13D25 |
-80.36 |
1.65 |
-8.61 |
2.29 |
0 |
|
|
353717 |
127285294 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-54.32 |
2.2 |
-8.84 |
-0.2 |
0 |
|
|
353718 |
127285295 |
1 |
SO2N3C16H23 |
AB2C3D16E23 |
-63.01 |
8.98 |
-9.32 |
-0.56 |
0 |
|
|
353719 |
127285296 |
1 |
SO2N3C21H31 |
AB2C3D21E31 |
-89.97 |
5.57 |
-8.75 |
-0.16 |
0 |
|
|
353720 |
127285297 |
1 |
ClO2N3C20H28 |
AB2C3D20E28 |
-89.08 |
3.41 |
-9.31 |
-0.23 |
0 |
|
|
353721 |
127285298 |
1 |
ClSN2O3C18H25 |
ABC2D3E18F25 |
-118.18 |
4.93 |
-9.41 |
-0.14 |
0 |
|
|
353722 |
127285299 |
1 |
ClON3C19H24 |
ABC3D19E24 |
-14.56 |
6.54 |
-9.52 |
-0.41 |
0 |
|
|
353723 |
127285300 |
1 |
ClOSN3C20H20 |
ABCD3E20F20 |
16.5 |
1.67 |
-8.65 |
-1.03 |
0 |
|
|
353724 |
127285301 |
1 |
ClN2O2C17H23 |
AB2C2D17E23 |
-80.56 |
2.55 |
-9.55 |
-0.3 |
0 |
|
|
353725 |
127285302 |
1 |
ClN5C13H16 |
AB5C13D16 |
93.28 |
7.49 |
-9.69 |
-0.53 |
0 |
|
|
353726 |
127285303 |
1 |
ClN5C15H20 |
AB5C15D20 |
78.23 |
6.26 |
-9.66 |
-0.47 |
0 |
|
|
353727 |
127285304 |
1 |
SO2N5C18H23 |
AB2C5D18E23 |
-20.75 |
3.89 |
-8.38 |
-0.22 |
0 |
|
|
353728 |
127285305 |
1 |
O2N5C20H31 |
A2B5C20D31 |
-44.79 |
3.99 |
-8.62 |
0.02 |
0 |
|
|
353729 |
127285306 |
1 |
O2N5C19H31 |
A2B5C19D31 |
-66.77 |
4.6 |
-8.64 |
0.12 |
0 |
|
|
353730 |
127285307 |
1 |
O3N5C19H29 |
A3B5C19D29 |
-112.6 |
6.63 |
-8.72 |
-0.04 |
0 |
|
|
353731 |
127285308 |
1 |
O3N4C17H26 |
A3B4C17D26 |
-102.85 |
5.58 |
-8.68 |
0.09 |
0 |
|
|
353732 |
127285309 |
1 |
ON6C17H24 |
AB6C17D24 |
57.15 |
5.06 |
-8.47 |
0.18 |
0 |
|
|
353733 |
127285310 |
1 |
FSN3O3C18H26 |
ABC3D3E18F26 |
-135.39 |
6.4 |
-8.96 |
-1.04 |
0 |
|
|
353734 |
127285311 |
1 |
FSO3N4C18H25 |
ABC3D4E18F25 |
-96.73 |
4.77 |
-9.06 |
-0.94 |
0 |
|
|
353735 |
127285312 |
1 |
FSN3O3C19H28 |
ABC3D3E19F28 |
-165.32 |
6.85 |
-8.74 |
-0.91 |
0 |
|
|
353736 |
127285313 |
1 |
FSO3N4C18H25 |
ABC3D4E18F25 |
-102.18 |
1.92 |
-9.2 |
-1.05 |
0 |
|
|
353737 |
127285314 |
1 |
FSN3O3C19H28 |
ABC3D3E19F28 |
-164.46 |
5.47 |
-8.98 |
-1.02 |
0 |
|
|
353738 |
127285315 |
1 |
FSN3O3C19H28 |
ABC3D3E19F28 |
-171.69 |
5.92 |
-9.13 |
-1.03 |
0 |
|
|
353739 |
127285316 |
1 |
FSN3O3C19H28 |
ABC3D3E19F28 |
-167.3 |
7.63 |
-9.18 |
-1.01 |
0 |
|
|
353740 |
127285317 |
1 |
FSN4O4C17H23 |
ABC4D4E17F23 |
-176.06 |
5.78 |
-9.39 |
-0.86 |
0 |
|
|
353741 |
127285318 |
1 |
FSN3O3C19H28 |
ABC3D3E19F28 |
-157.5 |
7.6 |
-8.96 |
-0.87 |
0 |
|
|
353742 |
127285319 |
1 |
FSN3O3C19H28 |
ABC3D3E19F28 |
-168.48 |
8.45 |
-9.08 |
-0.58 |
0 |
|
|
353743 |
127285320 |
1 |
FSO2N5C18H24 |
ABC2D5E18F24 |
-69.66 |
9.63 |
-9.16 |
-1.03 |
0 |
|
|
353744 |
127285321 |
1 |
FSO2N5C18H24 |
ABC2D5E18F24 |
-41.18 |
7.4 |
-8.98 |
-0.77 |
0 |
|
|
353745 |
127285322 |
1 |
O2N3C24H35 |
A2B3C24D35 |
-102.28 |
5.95 |
-9.33 |
0.17 |
0 |
|
|
353746 |
127285323 |
1 |
SO2N4C15H22 |
AB2C4D15E22 |
-58.67 |
4.65 |
-9.12 |
-0.67 |
0 |
|
|
353747 |
127285324 |
1 |
SO2N4C18H26 |
AB2C4D18E26 |
-76.34 |
5.28 |
-8.75 |
-0.32 |
0 |
|
|
353748 |
127285325 |
1 |
SO2N4C17H24 |
AB2C4D17E24 |
-70.25 |
3.69 |
-8.42 |
-0.25 |
0 |
|
|
353749 |
127285326 |
1 |
O2N3C21H29 |
A2B3C21D29 |
-75.39 |
5.78 |
-9.33 |
0.29 |
0 |
|
|
353750 |
127285327 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-130.19 |
6.25 |
-9.36 |
0.07 |
0 |
|
|
353751 |
127285328 |
1 |
ON6C18H24 |
AB6C18D24 |
44.37 |
8.81 |
-9.2 |
-0.94 |
0 |
|
|
353752 |
127285329 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-12.95 |
1.75 |
-9.38 |
-0.63 |
0 |
|
|
353753 |
127285330 |
1 |
N3O3C16H27 |
A3B3C16D27 |
-146.59 |
5.32 |
-9.03 |
0.78 |
0 |
|
|
353754 |
127285331 |
1 |
SO2N6C18H22 |
AB2C6D18E22 |
0.33 |
6.13 |
-8.99 |
-1.63 |
0 |
|
|
353755 |
127285332 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-28.75 |
6.42 |
-9.28 |
-0.75 |
0 |
|
|
353756 |
127285333 |
1 |
O2N4C15H22 |
A2B4C15D22 |
-14.75 |
1.79 |
-9.42 |
-0.3 |
0 |
|
|
353757 |
127285334 |
1 |
ON6C14H22 |
AB6C14D22 |
37.6 |
8.57 |
-9.53 |
-0.33 |
0 |
|
|
353758 |
127285335 |
1 |
O3N4C18H30 |
A3B4C18D30 |
-148.84 |
4.97 |
-9.09 |
0.6 |
0 |
|
|
353759 |
127285336 |
1 |
SO2N4C20H26 |
AB2C4D20E26 |
-55.44 |
1.3 |
-8.59 |
-0.66 |
0 |