List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
217927 |
85088601 |
1 |
ON4C26H28 |
AB4C26D28 |
60.35 |
10.03 |
-9.16 |
-0.15 |
0 |
|
|
217928 |
85088602 |
1 |
SO6C21H32 |
AB6C21D32 |
-281.96 |
2.84 |
-8.22 |
0.14 |
0 |
|
|
217929 |
85088603 |
1 |
O6C23H40 |
A6B23C40 |
-340.78 |
4.65 |
-9.53 |
1.0 |
0 |
|
|
217930 |
85088604 |
1 |
O6C23H40 |
A6B23C40 |
-320.73 |
1.31 |
-9.95 |
-0.47 |
0 |
|
|
217931 |
85088605 |
2 |
O2C13H18 |
A2B13C18 |
-191.25 |
4.8 |
-9.0 |
-0.25 |
0 |
|
|
217932 |
85088606 |
2 |
O2C13H18 |
A2B13C18 |
-168.36 |
3.2 |
-8.96 |
-0.58 |
0 |
|
|
217933 |
85088607 |
1 |
S2O5C20H28 |
A2B5C20D28 |
-135.14 |
15.86 |
-7.31 |
-2.8 |
0 |
|
|
217934 |
85088612 |
1 |
SSiO5C20H32 |
ABC5D20E32 |
-236.77 |
5.25 |
-8.9 |
-0.73 |
0 |
|
|
217935 |
85088613 |
1 |
SiO3C25H36 |
AB3C25D36 |
-157.76 |
4.0 |
-8.85 |
0.2 |
0 |
|
|
217936 |
85088619 |
1 |
BrN2O3H17C20 |
AB2C3D17E20 |
-29.3 |
8.09 |
-9.59 |
-0.92 |
0 |
|
|
217937 |
85088620 |
1 |
BO2F4C22H30 |
AB2C4D22E30 |
-401.34 |
12.51 |
0.0 |
0.0 |
0 |
|
|
217938 |
85088623 |
1 |
S2N3O6C16H19 |
A2B3C6D16E19 |
-130.17 |
10.69 |
-9.23 |
-1.18 |
0 |
|
|
217939 |
85088624 |
1 |
FN3O3C23H28 |
AB3C3D23E28 |
-108.83 |
9.28 |
-9.07 |
-1.79 |
0 |
|
|
217940 |
85088625 |
1 |
N3O4C23H31 |
A3B4C23D31 |
-97.92 |
8.02 |
-9.23 |
-0.99 |
0 |
|
|
217941 |
85088626 |
1 |
FNS2O4C19H24 |
ABC2D4E19F24 |
-206.09 |
6.66 |
-9.47 |
-0.61 |
0 |
|
|
217942 |
85088627 |
1 |
NS2O3C22H23 |
AB2C3D22E23 |
-51.48 |
6.46 |
-8.59 |
-0.45 |
0 |
|
|
217943 |
85088628 |
1 |
NSiO4C23H31 |
ABC4D23E31 |
-167.65 |
4.71 |
-8.38 |
-0.11 |
0 |
|
|
217944 |
85088629 |
1 |
ClO2N5C21H24 |
AB2C5D21E24 |
-4.93 |
5.25 |
-8.65 |
-0.3 |
0 |
|
|
217945 |
85088630 |
1 |
ClO2N3C23H28 |
AB2C3D23E28 |
-46.89 |
2.06 |
-8.45 |
-0.03 |
0 |
|
|
217946 |
85088631 |
1 |
ClFSSiN3H17C20 |
ABCDE3F17G20 |
15.52 |
2.49 |
-8.87 |
-0.85 |
0 |
|
|
217947 |
85088632 |
2 |
NO3C11H13 |
AB3C11D13 |
-232.58 |
9.14 |
-9.02 |
-0.77 |
0 |
|
|
217948 |
85088633 |
1 |
N2O4H22C25 |
A2B4C22D25 |
-80.36 |
5.77 |
-9.69 |
-1.3 |
0 |
|
|
217949 |
85088634 |
1 |
N4O5C21H26 |
A4B5C21D26 |
-129.35 |
6.43 |
-9.26 |
-0.95 |
0 |
|
|
217950 |
85088635 |
1 |
N4O5C21H26 |
A4B5C21D26 |
-140.49 |
5.31 |
-9.56 |
-0.52 |
0 |
|
|
217951 |
85088636 |
1 |
O3N4H22C24 |
A3B4C22D24 |
-20.15 |
3.98 |
-8.95 |
-0.87 |
0 |
|
|
217952 |
85088641 |
2 |
OH11C15 |
AB11C15 |
77.57 |
4.19 |
-9.03 |
-0.73 |
0 |
|
|
217953 |
85088645 |
1 |
O6C23H42 |
A6B23C42 |
-297.52 |
5.98 |
-9.56 |
0.6 |
0 |
|
|
217954 |
85088646 |
2 |
O2C13H19 |
A2B13C19 |
-163.4 |
1.7 |
-8.18 |
0.25 |
0 |
|
|
217955 |
85088650 |
1 |
BrSN2O3C17H23 |
ABC2D3E17F23 |
-133.15 |
1.87 |
-9.07 |
-0.62 |
0 |
|
|
217956 |
85088652 |
1 |
O3N5H21C23 |
A3B5C21D23 |
-11.57 |
4.99 |
-8.38 |
-1.01 |
0 |
|
|
217957 |
85088653 |
1 |
FNO5C23H26 |
ABC5D23E26 |
-215.2 |
4.41 |
-8.25 |
-0.19 |
0 |
|
|
217958 |
85088654 |
1 |
SO4N5C19H21 |
AB4C5D19E21 |
-46.38 |
7.25 |
-8.28 |
-0.77 |
0 |
|
|
217959 |
85088655 |
1 |
NO6C23H29 |
AB6C23D29 |
-242.28 |
3.8 |
-8.88 |
0.02 |
0 |
|
|
217960 |
85088656 |
1 |
NO4H25C26 |
AB4C25D26 |
-70.53 |
5.44 |
-8.99 |
-0.46 |
0 |
|
|
217961 |
85088659 |
1 |
NSi2O4C20H41 |
AB2C4D20E41 |
-305.4 |
2.45 |
-8.9 |
-0.04 |
0 |
|
|
217962 |
85088660 |
1 |
ClFO2N5C20H23 |
ABC2D5E20F23 |
-62.87 |
5.69 |
-9.06 |
-1.1 |
0 |
|
|
217963 |
85088662 |
1 |
PN2O10C15H21 |
AB2C10D15E21 |
-474.98 |
1.63 |
-8.95 |
-0.31 |
0 |
|
|
217964 |
85088663 |
1 |
O3F4N4C18H26 |
A3B4C4D18E26 |
-328.05 |
4.61 |
-9.38 |
-0.06 |
0 |
|
|
217965 |
85088664 |
1 |
F2N2O5H18C21 |
A2B2C5D18E21 |
-249.47 |
5.91 |
-9.35 |
-1.81 |
0 |
|
|
217966 |
85088666 |
1 |
N4O8C17H28 |
A4B8C17D28 |
-352.06 |
3.37 |
-10.3 |
-0.22 |
0 |
|
|
217967 |
85088667 |
1 |
O7C23H28 |
A7B23C28 |
-235.72 |
4.04 |
-8.37 |
0.1 |
0 |
|
|
217968 |
85088668 |
1 |
N2O4H24C25 |
A2B4C24D25 |
-49.95 |
7.88 |
-9.02 |
-0.81 |
0 |
|
|
217969 |
85088670 |
1 |
O4C27H28 |
A4B27C28 |
-73.02 |
1.64 |
-9.08 |
0.15 |
0 |
|
|
217970 |
85088672 |
1 |
SO5C23H28 |
AB5C23D28 |
-184.4 |
4.34 |
-8.73 |
0.01 |
0 |
|
|
217971 |
85088673 |
1 |
SN2O4C22H28 |
AB2C4D22E28 |
-123.29 |
10.52 |
-8.96 |
-0.63 |
0 |
|
|
217972 |
85088674 |
1 |
SN2O4C22H28 |
AB2C4D22E28 |
-95.08 |
6.44 |
-8.69 |
-1.06 |
0 |
|
|
217973 |
85088675 |
1 |
O5C25H36 |
A5B25C36 |
-250.36 |
4.44 |
-9.49 |
-0.29 |
0 |
|
|
217974 |
85088677 |
1 |
O3C27H44 |
A3B27C44 |
-173.57 |
3.13 |
-9.2 |
1.48 |
0 |
|
|
217975 |
85088678 |
2 |
OC14H24 |
AB14C24 |
-158.52 |
1.78 |
-9.76 |
2.23 |
0 |
|
|
217976 |
85088680 |
1 |
SnO2C19H38 |
AB2C19D38 |
-129.4 |
1.47 |
-9.55 |
0.1 |
0 |