List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
21196 |
587603 |
1 |
N2O4H14C17 |
A2B4C14D17 |
-93.85 |
4.8 |
-9.06 |
-0.95 |
0 |
|
|
21197 |
587611 |
1 |
NCl2S2O3H9C13 |
AB2C2D3E9F13 |
-76.99 |
4.45 |
-9.01 |
-2.17 |
0 |
|
|
21198 |
587612 |
1 |
O5C27H40 |
A5B27C40 |
-149.94 |
6.85 |
-9.23 |
-0.36 |
0 |
|
|
21199 |
587615 |
1 |
ClNO4H12C19 |
ABC4D12E19 |
8.79 |
5.9 |
-9.34 |
-1.72 |
0 |
|
|
21200 |
587616 |
1 |
NCl2O3H11C21 |
AB2C3D11E21 |
-40.25 |
3.7 |
-9.36 |
-1.74 |
0 |
|
|
21201 |
587617 |
1 |
ClNO4C19H20 |
ABC4D19E20 |
-145.67 |
5.08 |
-8.75 |
-0.8 |
0 |
|
|
21202 |
587622 |
1 |
ClNO4C23H24 |
ABC4D23E24 |
-145.56 |
3.75 |
-8.54 |
-0.85 |
0 |
|
|
21203 |
587623 |
3 |
OC11H18 |
AB11C18 |
-210.09 |
3.24 |
-9.39 |
0.85 |
0 |
|
|
21204 |
587632 |
1 |
NPSO2C10H22 |
ABCD2E10F22 |
-164.12 |
2.6 |
-9.18 |
0.47 |
0 |
|
|
21205 |
587645 |
1 |
ON4C5H8 |
AB4C5D8 |
24.09 |
1.74 |
-8.82 |
-0.56 |
0 |
|
|
21206 |
587661 |
1 |
ON4C5H8 |
AB4C5D8 |
-2.71 |
1.9 |
-9.15 |
-0.21 |
0 |
|
|
21207 |
587665 |
1 |
O5C11H12 |
A5B11C12 |
-200.03 |
5.45 |
-9.53 |
-0.32 |
0 |
|
|
21208 |
587666 |
2 |
FOC7H9 |
ABC7D9 |
-191.99 |
1.6 |
-9.88 |
-0.54 |
0 |
|
|
21209 |
587668 |
1 |
ON4C5H8 |
AB4C5D8 |
-6.12 |
9.43 |
-9.44 |
-0.1 |
0 |
|
|
21210 |
587669 |
1 |
NSC8H13 |
ABC8D13 |
1.1 |
0.48 |
-9.01 |
-0.16 |
0 |
|
|
21211 |
587670 |
1 |
ON2C12H22 |
AB2C12D22 |
-57.21 |
2.21 |
-8.44 |
2.2 |
0 |
|
|
21212 |
587681 |
1 |
NSO3C18H29 |
ABC3D18E29 |
-129.67 |
6.76 |
-9.51 |
-0.41 |
0 |
|
|
21213 |
587690 |
1 |
O2C15H26 |
A2B15C26 |
-132.77 |
1.64 |
-9.32 |
2.44 |
0 |
|
|
21214 |
587694 |
1 |
O2F3H3C4 |
A2B3C3D4 |
-227.31 |
4.19 |
-11.63 |
-1.19 |
0 |
|
|
21215 |
587699 |
2 |
NOC8H14 |
ABC8D14 |
-93.66 |
1.28 |
-9.4 |
0.38 |
0 |
|
|
21216 |
587702 |
2 |
OC4H6 |
AB4C6 |
-67.7 |
5.28 |
-10.86 |
-0.4 |
0 |
|
|
21217 |
587704 |
1 |
SN2C6H8 |
AB2C6D8 |
23.19 |
2.64 |
-9.28 |
-0.49 |
0 |
|
|
21218 |
587705 |
2 |
NOC9H13 |
ABC9D13 |
-102.26 |
3.52 |
-8.65 |
0.4 |
0 |
|
|
21219 |
587707 |
1 |
BNO3C9H18 |
ABC3D9E18 |
-206.85 |
2.15 |
-9.67 |
0.37 |
0 |
|
|
21220 |
587708 |
1 |
O2C9H18 |
A2B9C18 |
-134.66 |
0.65 |
-10.13 |
2.63 |
0 |
|
|
21221 |
587710 |
1 |
ClN3O3C18H20 |
AB3C3D18E20 |
-68.43 |
3.68 |
-9.68 |
-0.91 |
0 |
|
|
21222 |
587711 |
2 |
FH3C4 |
AB3C4 |
-60.47 |
1.42 |
-9.5 |
-0.22 |
0 |
|
|
21223 |
587712 |
1 |
O5C17H24 |
A5B17C24 |
-196.15 |
5.18 |
-9.63 |
0.68 |
0 |
|
|
21224 |
587713 |
1 |
NSO4C16H25 |
ABC4D16E25 |
-159.28 |
5.84 |
-9.04 |
-0.64 |
0 |
|
|
21225 |
587714 |
1 |
SN2O2H16C18 |
AB2C2D16E18 |
11.27 |
5.66 |
-8.72 |
-0.63 |
0 |
|
|
21226 |
587715 |
1 |
NSO4C14H17 |
ABC4D14E17 |
-132.31 |
6.02 |
-9.42 |
-0.54 |
0 |
|
|
21227 |
587716 |
2 |
NOH7C9 |
ABC7D9 |
24.78 |
2.23 |
-8.86 |
-0.83 |
0 |
|
|
21228 |
587725 |
1 |
NO2C27H41 |
AB2C27D41 |
-131.6 |
3.47 |
-9.27 |
0.42 |
0 |
|
|
21229 |
587726 |
1 |
NO5C33H53 |
AB5C33D53 |
-308.67 |
4.1 |
-9.18 |
0.82 |
0 |
|
|
21230 |
587746 |
1 |
O5C14H18 |
A5B14C18 |
-215.23 |
9.41 |
-9.69 |
-0.12 |
0 |
|
|
21231 |
587748 |
4 |
OC2H3 |
AB2C3 |
-172.77 |
2.62 |
-10.31 |
-0.26 |
0 |
|
|
21232 |
587749 |
2 |
OC7H11 |
AB7C11 |
-118.75 |
3.03 |
-9.88 |
0.72 |
0 |
|
|
21233 |
587750 |
1 |
O4C9H14 |
A4B9C14 |
-185.71 |
1.7 |
-10.46 |
-0.26 |
0 |
|
|
21234 |
587751 |
1 |
ClOSN3H10C14 |
ABCD3E10F14 |
35.3 |
3.21 |
-8.97 |
-1.32 |
0 |
|
|
21235 |
587752 |
1 |
ClON5H6C8 |
ABC5D6E8 |
48.79 |
2.6 |
-10.32 |
-1.12 |
0 |
|
|
21236 |
587758 |
1 |
O3N4H10C12 |
A3B4C10D12 |
-17.73 |
4.48 |
-8.96 |
-1.33 |
0 |
|
|
21237 |
587759 |
1 |
IN3O3C7H10 |
AB3C3D7E10 |
-65.62 |
5.62 |
-9.37 |
-1.49 |
0 |
|
|
21238 |
587760 |
1 |
N3O3F4H13C16 |
A3B3C4D13E16 |
-209.76 |
4.93 |
-9.7 |
-1.38 |
0 |
|
|
21239 |
587761 |
1 |
N2O5C25H34 |
A2B5C25D34 |
-173.25 |
2.77 |
-7.73 |
0.22 |
0 |
|
|
21240 |
587762 |
1 |
NiC11H16 |
AB11C16 |
21.2 |
2.44 |
-7.26 |
1.13 |
-8 |
|
|
21241 |
587763 |
1 |
C6H11 |
A6B11 |
6.0 |
0.44 |
0.0 |
0.0 |
-3 |
|
|
21242 |
587765 |
1 |
SN2C6H8 |
AB2C6D8 |
50.56 |
3.67 |
-8.72 |
-0.13 |
0 |
|
|
21243 |
587766 |
1 |
O3C7H8 |
A3B7C8 |
-102.74 |
2.36 |
-8.41 |
-0.11 |
0 |
|
|
21244 |
587767 |
1 |
O3C10H14 |
A3B10C14 |
-105.34 |
3.52 |
-9.47 |
0.34 |
0 |
|
|
21245 |
587768 |
1 |
OPC11H15 |
ABC11D15 |
-52.54 |
4.73 |
-9.76 |
-0.02 |
0 |