List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
51888 |
12014648 |
1 |
SiO5C15H28 |
AB5C15D28 |
-280.27 |
3.81 |
-8.78 |
0.24 |
0 |
|
|
51889 |
12014650 |
1 |
ClOH4F11C13 |
ABC4D11E13 |
-535.93 |
2.58 |
-10.27 |
-1.68 |
0 |
|
|
51890 |
12014652 |
1 |
ClPF3O3C4H7 |
ABC3D3E4F7 |
-345.26 |
3.22 |
-10.97 |
-0.24 |
0 |
|
|
51891 |
12014653 |
1 |
PCl2O3C6F6H7 |
AB2C3D6E6F7 |
-508.8 |
4.32 |
-11.34 |
-0.7 |
0 |
|
|
51893 |
12014657 |
1 |
ClSO2F5C12H22 |
ABC2D5E12F22 |
-393.88 |
6.55 |
-10.89 |
-1.0 |
0 |
|
|
51894 |
12014658 |
1 |
BMoNO2P2F4C37H40 |
ABCD2E2F4G37H40 |
-24.13 |
9.27 |
-7.75 |
-1.01 |
0 |
|
|
51896 |
12014660 |
1 |
BMoP2O3F4C37H41 |
ABC2D3E4F37G41 |
-258.82 |
4.72 |
-6.68 |
-0.15 |
0 |
|
|
51898 |
12014662 |
1 |
BMoP2O3F4C36H39 |
ABC2D3E4F36G39 |
-322.35 |
9.55 |
-7.91 |
-0.4 |
0 |
|
|
51903 |
12014668 |
1 |
NO2C19H25 |
AB2C19D25 |
-65.86 |
5.0 |
-8.89 |
0.45 |
0 |
|
|
51904 |
12014669 |
1 |
NO2C19H25 |
AB2C19D25 |
-66.33 |
3.04 |
-9.05 |
0.25 |
0 |
|
|
51905 |
12014670 |
1 |
NO2C19H25 |
AB2C19D25 |
-66.16 |
2.79 |
-9.08 |
0.16 |
0 |
|
|
51906 |
12014671 |
1 |
OC15H24 |
AB15C24 |
-30.13 |
2.72 |
-9.32 |
1.15 |
0 |
|
|
51907 |
12014673 |
1 |
O2C15H24 |
A2B15C24 |
-56.83 |
1.87 |
-9.76 |
1.04 |
0 |
|
|
51908 |
12014674 |
1 |
NCl2O2C20H23 |
AB2C2D20E23 |
-82.02 |
6.71 |
-9.45 |
-0.84 |
0 |
|
|
51909 |
12014676 |
1 |
NCl2O2C20H25 |
AB2C2D20E25 |
-95.16 |
6.21 |
-8.86 |
-0.45 |
0 |
|
|
51910 |
12014677 |
1 |
NCl2O2C20H25 |
AB2C2D20E25 |
-101.53 |
2.54 |
-9.28 |
-0.31 |
0 |
|
|
51911 |
12014678 |
1 |
CrO5C18H20 |
AB5C18D20 |
-55.55 |
1.3 |
-7.25 |
-0.37 |
0 |
|
|
51912 |
12014679 |
1 |
CrO5H20C21 |
AB5C20D21 |
-104.14 |
5.33 |
-7.78 |
-0.84 |
0 |
|
|
51913 |
12014680 |
2 |
OH7C9 |
AB7C9 |
-0.57 |
4.45 |
-8.83 |
-0.79 |
0 |
|
|
51914 |
12014683 |
1 |
CrO5C19H24 |
AB5C19D24 |
-11.91 |
6.28 |
-7.95 |
-0.01 |
0 |
|
|
51915 |
12014684 |
2 |
OC8H9 |
AB8C9 |
-56.73 |
3.44 |
-8.86 |
0.08 |
0 |
|
|
51916 |
12014685 |
2 |
OC8H9 |
AB8C9 |
-55.34 |
3.09 |
-8.86 |
0.05 |
0 |
|
|
51917 |
12014686 |
1 |
CrO6C21H24 |
AB6C21D24 |
-256.12 |
9.73 |
-8.37 |
-0.9 |
0 |
|
|
51918 |
12014687 |
3 |
OC6H6 |
AB6C6 |
-90.42 |
5.16 |
-8.99 |
-0.12 |
0 |
|
|
51919 |
12014688 |
3 |
OC6H6 |
AB6C6 |
-89.84 |
5.0 |
-8.98 |
-0.18 |
0 |
|
|
51920 |
12014689 |
1 |
CrNO4H25C27 |
ABC4D25E27 |
-10.9 |
6.2 |
-7.05 |
-0.9 |
0 |
|
|
51921 |
12014690 |
1 |
NOH19C24 |
ABC19D24 |
75.03 |
2.56 |
-8.73 |
-0.44 |
0 |
|
|
51922 |
12014691 |
1 |
CrNO6H31C35 |
ABC6D31E35 |
-97.18 |
4.95 |
-7.53 |
-0.58 |
0 |
|
|
51923 |
12014692 |
1 |
NO3H25C32 |
AB3C25D32 |
23.42 |
4.93 |
-8.52 |
-0.39 |
0 |
|
|
51924 |
12014693 |
1 |
CrO5C18H22 |
AB5C18D22 |
-147.14 |
6.42 |
-7.59 |
-0.16 |
0 |
|
|
51925 |
12014694 |
1 |
CrO5C19H24 |
AB5C19D24 |
-99.78 |
4.96 |
-8.19 |
-0.8 |
0 |
|
|
51926 |
12014695 |
2 |
OC8H9 |
AB8C9 |
-42.15 |
1.5 |
-8.68 |
0.08 |
0 |
|
|
51927 |
12014696 |
1 |
CrSiO5C24H36 |
ABC5D24E36 |
-193.66 |
4.86 |
-6.92 |
-0.02 |
0 |
|
|
51928 |
12014697 |
1 |
SiO2C21H30 |
AB2C21D30 |
-117.36 |
2.79 |
-8.66 |
-0.01 |
0 |
|
|
51929 |
12014699 |
2 |
OF2N2C20H22 |
AB2C2D20E22 |
7.81 |
4.48 |
-5.63 |
-3.38 |
0 |
|
|
51930 |
12014700 |
1 |
NPO6C19H24 |
ABC6D19E24 |
-272.44 |
3.6 |
-8.83 |
0.06 |
0 |
|
|
51931 |
12014701 |
1 |
N2O5C31H34 |
A2B5C31D34 |
-104.11 |
5.3 |
-8.7 |
0.03 |
0 |
|
|
51932 |
12014702 |
1 |
N2O5C35H36 |
A2B5C35D36 |
-90.63 |
4.58 |
-8.68 |
-0.56 |
0 |
|
|
51933 |
12014703 |
1 |
N2O5C33H38 |
A2B5C33D38 |
-120.16 |
3.03 |
-8.51 |
-0.05 |
0 |
|
|
51934 |
12014704 |
1 |
N2O5C27H34 |
A2B5C27D34 |
-142.88 |
2.77 |
-8.53 |
0.18 |
0 |
|
|
51935 |
12014705 |
2 |
O2H8C9 |
A2B8C9 |
-104.28 |
2.48 |
-9.43 |
-0.83 |
0 |
|
|
51936 |
12014706 |
1 |
S2O4C15H18 |
A2B4C15D18 |
-146.85 |
1.85 |
-9.07 |
-0.24 |
0 |
|
|
51937 |
12014707 |
1 |
S2O4C19H20 |
A2B4C19D20 |
-129.43 |
3.69 |
-8.86 |
-0.52 |
0 |
|
|
51938 |
12014708 |
1 |
N2O5C31H34 |
A2B5C31D34 |
-108.88 |
3.0 |
-8.68 |
0.04 |
0 |
|
|
51939 |
12014709 |
1 |
NSO3H23C24 |
ABC3D23E24 |
-30.73 |
7.57 |
-8.4 |
-0.55 |
0 |
|
|
51940 |
12014710 |
1 |
SO4H20C23 |
AB4C20D23 |
-70.92 |
5.65 |
-9.14 |
-0.57 |
0 |
|
|
51941 |
12014711 |
1 |
SO3H20C23 |
AB3C20D23 |
-39.39 |
6.24 |
-9.41 |
-0.64 |
0 |
|
|
51942 |
12014712 |
1 |
H14C23 |
A14B23 |
94.3 |
0.6 |
-8.48 |
-0.77 |
0 |
|
|
51943 |
12014713 |
1 |
NO5C25H45 |
AB5C25D45 |
-303.67 |
6.45 |
-9.78 |
0.72 |
0 |
|
|
51944 |
12014714 |
1 |
NO3C20H35 |
AB3C20D35 |
-191.85 |
5.33 |
-9.46 |
0.82 |
0 |