List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
200695 |
79429255 |
1 |
O3C16H20 |
A3B16C20 |
-125.13 |
4.08 |
-9.22 |
-0.26 |
0 |
|
|
200696 |
79429633 |
1 |
NO3H15C16 |
AB3C15D16 |
-74.12 |
4.57 |
-9.18 |
-0.37 |
0 |
|
|
200697 |
79429918 |
1 |
ClNOC18H20 |
ABCD18E20 |
-19.57 |
2.6 |
-8.41 |
-0.11 |
0 |
|
|
200698 |
79429919 |
1 |
BrClN3C16H21 |
ABC3D16E21 |
28.21 |
1.03 |
-9.15 |
-0.03 |
0 |
|
|
200699 |
79429920 |
1 |
ClN3C17H24 |
AB3C17D24 |
24.58 |
6.29 |
-9.13 |
0.22 |
0 |
|
|
200700 |
79429921 |
1 |
ClN3C17H22 |
AB3C17D22 |
33.13 |
6.19 |
-9.13 |
0.22 |
0 |
|
|
200701 |
79429922 |
1 |
ClNF3H15C16 |
ABC3D15E16 |
-133.28 |
1.17 |
-9.44 |
-0.68 |
0 |
|
|
200702 |
79430280 |
1 |
BrFN2C14H16 |
ABC2D14E16 |
-2.59 |
3.32 |
-9.36 |
-0.11 |
0 |
|
|
200703 |
79430424 |
1 |
ClN3C17H24 |
AB3C17D24 |
24.0 |
3.73 |
-8.75 |
0.44 |
0 |
|
|
200704 |
79430575 |
1 |
NBr2C18H19 |
AB2C18D19 |
61.9 |
2.76 |
-9.26 |
-0.2 |
0 |
|
|
200705 |
79430576 |
1 |
BrClNC18H19 |
ABCD18E19 |
50.24 |
2.71 |
-9.21 |
-0.18 |
0 |
|
|
200706 |
79430691 |
1 |
NSC19H27 |
ABC19D27 |
11.76 |
2.23 |
-8.78 |
-0.05 |
0 |
|
|
200707 |
79430692 |
1 |
NOC19H31 |
ABC19D31 |
-68.95 |
1.67 |
-8.71 |
0.45 |
0 |
|
|
200708 |
79430709 |
1 |
NC20H35 |
AB20C35 |
-49.98 |
1.42 |
-8.65 |
0.43 |
0 |
|
|
200709 |
79430710 |
1 |
NSC19H27 |
ABC19D27 |
11.0 |
1.23 |
-8.72 |
-0.06 |
0 |
|
|
200710 |
79430711 |
1 |
NOC19H31 |
ABC19D31 |
-70.74 |
2.0 |
-8.66 |
0.63 |
0 |
|
|
200711 |
79430712 |
1 |
NSO2C17H29 |
ABC2D17E29 |
-110.33 |
6.31 |
-8.65 |
0.29 |
0 |
|
|
200712 |
79430835 |
1 |
BrNSC18H24 |
ABCD18E24 |
19.88 |
2.85 |
-8.9 |
-0.15 |
0 |
|
|
200713 |
79431104 |
1 |
BrClO3H14C16 |
ABC3D14E16 |
-90.24 |
6.24 |
-9.16 |
-0.8 |
0 |
|
|
200714 |
79431105 |
1 |
ClSO2H13C17 |
ABC2D13E17 |
-35.53 |
2.64 |
-8.67 |
-0.64 |
0 |
|
|
200715 |
79431164 |
1 |
BrOF3H14C16 |
ABC3D14E16 |
-169.92 |
1.46 |
-9.65 |
-0.82 |
0 |
|
|
200716 |
79431165 |
1 |
BrON2C17H17 |
ABC2D17E17 |
26.77 |
4.78 |
-8.75 |
-0.39 |
0 |
|
|
200717 |
79431166 |
1 |
BrClON2C16H20 |
ABCD2E16F20 |
-19.25 |
1.41 |
-9.27 |
-0.2 |
0 |
|
|
200718 |
79431260 |
1 |
BrNC14H20 |
ABC14D20 |
2.25 |
3.65 |
-9.03 |
0.15 |
0 |
|
|
200719 |
79431500 |
1 |
BrFCl2H12C15 |
ABC2D12E15 |
-29.98 |
3.03 |
-9.69 |
-0.49 |
0 |
|
|
200720 |
79431501 |
1 |
BrClN2C13H14 |
ABC2D13E14 |
44.38 |
3.07 |
-9.36 |
-0.14 |
0 |
|
|
200721 |
79431502 |
1 |
ClBr2N2C15H17 |
AB2C2D15E17 |
31.57 |
1.35 |
-9.28 |
-0.29 |
0 |
|
|
200722 |
79431506 |
1 |
ClBr2H13C15 |
AB2C13D15 |
28.6 |
2.65 |
-9.47 |
-0.46 |
0 |
|
|
200723 |
79431609 |
1 |
BrNSC18H24 |
ABCD18E24 |
18.26 |
2.69 |
-9.03 |
-0.14 |
0 |
|
|
200724 |
79431610 |
1 |
BrNSO2C16H26 |
ABCD2E16F26 |
-99.29 |
5.21 |
-8.8 |
0.06 |
0 |
|
|
200725 |
79431611 |
1 |
BrNSO2C16H24 |
ABCD2E16F24 |
-90.6 |
6.63 |
-9.33 |
-0.39 |
0 |
|
|
200726 |
79431612 |
1 |
NSBr2C17H21 |
ABC2D17E21 |
26.61 |
3.51 |
-9.04 |
-0.5 |
0 |
|
|
200727 |
79431794 |
1 |
FNC16H24 |
ABC16D24 |
-55.44 |
3.44 |
-8.98 |
0.24 |
0 |
|
|
200728 |
79432650 |
1 |
OCl2N2C16H20 |
AB2C2D16E20 |
-30.78 |
1.53 |
-9.07 |
-0.4 |
0 |
|
|
200729 |
79432913 |
1 |
FNC19H24 |
ABC19D24 |
-34.69 |
3.27 |
-8.88 |
0.2 |
0 |
|
|
200730 |
79433270 |
1 |
FBr2H13C15 |
AB2C13D15 |
-10.43 |
2.15 |
-9.61 |
-0.36 |
0 |
|
|
200731 |
79433556 |
1 |
ClNOC18H30 |
ABCD18E30 |
-71.46 |
1.32 |
-9.11 |
-0.13 |
0 |
|
|
200732 |
79434288 |
1 |
ClFOH16C17 |
ABCD16E17 |
-59.09 |
1.69 |
-8.87 |
-0.18 |
0 |
|
|
200733 |
79434613 |
1 |
ClFSO2C12H16 |
ABCD2E12F16 |
-139.41 |
5.3 |
-9.56 |
-0.02 |
0 |
|
|
200734 |
79435586 |
1 |
BrNO2C16H20 |
ABC2D16E20 |
-93.44 |
4.34 |
-9.77 |
-0.52 |
0 |
|
|
200735 |
79435693 |
1 |
O3C14H20 |
A3B14C20 |
-137.08 |
4.72 |
-9.66 |
-0.17 |
0 |
|
|
200736 |
79435789 |
1 |
BrO2H15C16 |
AB2C15D16 |
-51.75 |
5.26 |
-9.63 |
-0.35 |
0 |
|
|
200737 |
79435790 |
1 |
O4C13H18 |
A4B13C18 |
-167.62 |
6.07 |
-9.64 |
-0.11 |
0 |
|
|
200738 |
79435835 |
1 |
NCl2C16H17 |
AB2C16D17 |
13.97 |
5.04 |
-9.14 |
-0.14 |
0 |
|
|
200739 |
79435836 |
1 |
NC19H25 |
AB19C25 |
2.41 |
2.05 |
-8.73 |
0.39 |
0 |
|
|
200740 |
79435837 |
1 |
NC18H23 |
AB18C23 |
16.32 |
1.9 |
-8.61 |
0.46 |
0 |
|
|
200741 |
79436147 |
1 |
NOC12H19 |
ABC12D19 |
-39.91 |
1.33 |
-9.04 |
0.38 |
0 |
|
|
200742 |
79436148 |
1 |
ClNF2C17H18 |
ABC2D17E18 |
-70.3 |
2.57 |
-9.16 |
-0.21 |
0 |
|
|
200743 |
79436149 |
1 |
ClNC19H24 |
ABC19D24 |
14.12 |
2.47 |
-8.96 |
-0.05 |
0 |
|
|
200744 |
79436212 |
1 |
O2C13H16 |
A2B13C16 |
-68.4 |
4.69 |
-9.39 |
0.08 |
0 |