List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
326573 |
126687810 |
1 |
OF3C11H11 |
AB3C11D11 |
-197.47 |
3.86 |
-9.72 |
-0.55 |
0 |
|
|
326574 |
126687813 |
1 |
NF3C17H18 |
AB3C17D18 |
-71.2 |
4.31 |
-7.9 |
-0.43 |
0 |
|
|
326575 |
126687814 |
1 |
N2O3C15H20 |
A2B3C15D20 |
-119.72 |
5.96 |
-8.72 |
-0.03 |
0 |
|
|
326576 |
126687816 |
1 |
NO2F5C25H26 |
AB2C5D25E26 |
-323.2 |
5.39 |
-8.77 |
-0.71 |
0 |
|
|
326577 |
126687817 |
1 |
NF3O4C28H34 |
AB3C4D28E34 |
-317.35 |
3.87 |
-8.62 |
-0.49 |
0 |
|
|
326578 |
126687818 |
1 |
N2O2F3C18H25 |
A2B2C3D18E25 |
-252.75 |
3.83 |
-8.87 |
-0.53 |
0 |
|
|
326579 |
126687819 |
1 |
NF3O3C27H32 |
AB3C3D27E32 |
-267.91 |
3.63 |
-8.69 |
-0.58 |
0 |
|
|
326580 |
126687820 |
1 |
N2O2F3C19H25 |
A2B2C3D19E25 |
-253.52 |
3.94 |
-8.84 |
-0.38 |
0 |
|
|
326581 |
126687824 |
1 |
NO2C18H35 |
AB2C18D35 |
-156.83 |
6.49 |
-9.26 |
1.07 |
0 |
|
|
326582 |
126687825 |
1 |
ON2C12H24 |
AB2C12D24 |
-85.45 |
4.49 |
-8.9 |
1.33 |
0 |
|
|
326583 |
126687826 |
1 |
NO3C9H13 |
AB3C9D13 |
-103.49 |
5.66 |
-9.98 |
-0.29 |
0 |
|
|
326584 |
126687828 |
1 |
NO2C15H21 |
AB2C15D21 |
-82.76 |
4.7 |
-8.55 |
-0.3 |
0 |
|
|
326585 |
126687829 |
1 |
PN2O19C81H151 |
AB2C19D81E151 |
-1225.22 |
8.98 |
-10.24 |
-0.1 |
0 |
|
|
326586 |
126687830 |
1 |
N2O5C20H28 |
A2B5C20D28 |
-221.27 |
2.06 |
-9.59 |
0.0 |
0 |
|
|
326587 |
126687831 |
1 |
N7O13C56H85 |
A7B13C56D85 |
-642.78 |
8.05 |
-8.49 |
-0.32 |
0 |
|
|
326588 |
126687832 |
1 |
N2O3C12H22 |
A2B3C12D22 |
-158.33 |
2.51 |
-9.46 |
0.86 |
0 |
|
|
326589 |
126687833 |
1 |
N8O13C58H88 |
A8B13C58D88 |
-623.16 |
3.37 |
-9.08 |
-0.41 |
0 |
|
|
326590 |
126687834 |
1 |
N9O13C53H79 |
A9B13C53D79 |
-607.69 |
3.38 |
-8.69 |
-0.43 |
0 |
|
|
326591 |
126687835 |
1 |
N9O11C47H73 |
A9B11C47D73 |
-508.73 |
6.98 |
-8.88 |
-0.49 |
0 |
|
|
326592 |
126687837 |
1 |
N7O8C43H73 |
A7B8C43D73 |
-415.1 |
4.18 |
-8.7 |
0.08 |
0 |
|
|
326593 |
126687842 |
2 |
NC6H10 |
AB6C10 |
-6.2 |
1.89 |
-7.98 |
0.51 |
0 |
|
|
326594 |
126687844 |
1 |
N8O12C49H76 |
A8B12C49D76 |
-545.45 |
5.37 |
-9.22 |
-0.68 |
0 |
|
|
326595 |
126687848 |
1 |
N7O11C57H83 |
A7B11C57D83 |
-460.61 |
7.06 |
-8.6 |
0.06 |
0 |
|
|
326596 |
126687852 |
1 |
N5O6C30H51 |
A5B6C30D51 |
-304.7 |
1.65 |
-9.57 |
-0.18 |
0 |
|
|
326597 |
126687853 |
1 |
N8O11C55H80 |
A8B11C55D80 |
-455.95 |
12.39 |
-8.83 |
-0.52 |
0 |
|
|
326598 |
126687858 |
1 |
N8O11C48H74 |
A8B11C48D74 |
-510.81 |
1.29 |
-9.04 |
-0.85 |
0 |
|
|
326599 |
126687860 |
1 |
N8O11C48H74 |
A8B11C48D74 |
-520.83 |
3.54 |
-8.96 |
-0.62 |
0 |
|
|
326600 |
126687861 |
2 |
N4O6C24H37 |
A4B6C24D37 |
-547.19 |
9.27 |
-9.02 |
-0.46 |
0 |
|
|
326601 |
126687862 |
1 |
N8O11C51H80 |
A8B11C51D80 |
-524.95 |
4.38 |
-8.62 |
-0.43 |
0 |
|
|
326602 |
126687863 |
1 |
OF3N5C33H34 |
AB3C5D33E34 |
-46.88 |
5.15 |
-8.88 |
-0.93 |
0 |
|
|
326603 |
126687867 |
1 |
O3C12H16 |
A3B12C16 |
-11.21 |
1.11 |
-9.77 |
0.9 |
0 |
|
|
326604 |
126687868 |
1 |
F3N3O3C17H20 |
A3B3C3D17E20 |
-252.38 |
5.74 |
-10.02 |
-0.98 |
0 |
|
|
326605 |
126687869 |
1 |
N3C11H21 |
A3B11C21 |
18.7 |
4.67 |
-9.17 |
0.57 |
0 |
|
|
326606 |
126687872 |
1 |
N7O10C44H65 |
A7B10C44D65 |
-463.2 |
2.34 |
-9.33 |
-0.69 |
0 |
|
|
326607 |
126687874 |
1 |
SN8O12C46H70 |
AB8C12D46E70 |
-537.07 |
9.73 |
-9.05 |
-0.84 |
0 |
|
|
326608 |
126687875 |
1 |
N7O12C48H73 |
A7B12C48D73 |
-543.02 |
3.95 |
-8.94 |
-0.53 |
0 |
|
|
326609 |
126687876 |
1 |
SF4O5N7C27H27 |
AB4C5D7E27F27 |
-248.24 |
18.32 |
-8.08 |
-2.23 |
0 |
|
|
326610 |
126687877 |
1 |
SF4O5N7C27H29 |
AB4C5D7E27F29 |
-258.72 |
13.99 |
-8.03 |
-2.21 |
0 |
|
|
326611 |
126687882 |
1 |
N8O11C45H68 |
A8B11C45D68 |
-494.18 |
4.95 |
-9.23 |
-1.1 |
0 |
|
|
326612 |
126687886 |
1 |
N2C11H14 |
A2B11C14 |
30.98 |
1.49 |
-9.34 |
-0.56 |
0 |
|
|
326613 |
126687887 |
1 |
N3O5C24H37 |
A3B5C24D37 |
-229.29 |
2.66 |
-9.74 |
0.0 |
0 |
|
|
326614 |
126687888 |
1 |
N4O5C23H36 |
A4B5C23D36 |
-215.68 |
4.85 |
-9.36 |
0.12 |
0 |
|
|
326615 |
126687890 |
1 |
N5O6C38H65 |
A5B6C38D65 |
-331.46 |
0.98 |
-9.49 |
0.16 |
0 |
|
|
326616 |
126687891 |
1 |
N3O3C13H25 |
A3B3C13D25 |
-157.01 |
1.51 |
-10.06 |
0.36 |
0 |
|
|
326617 |
126687894 |
1 |
SO3N6C33H38 |
AB3C6D33E38 |
-38.29 |
4.1 |
-8.05 |
-0.61 |
0 |
|
|
326618 |
126687897 |
1 |
O3N4C15H16 |
A3B4C15D16 |
-17.95 |
5.89 |
-8.85 |
-0.71 |
0 |
|
|
326619 |
126687899 |
1 |
N2O3C16H16 |
A2B3C16D16 |
-24.71 |
6.58 |
-9.17 |
-0.82 |
0 |
|
|
326620 |
126687900 |
1 |
ON2C9H12 |
AB2C9D12 |
-2.92 |
4.24 |
-8.62 |
-0.06 |
0 |
|
|
326621 |
126687901 |
1 |
NOH17C18 |
ABC17D18 |
61.4 |
2.15 |
-8.3 |
0.03 |
0 |
|
|
326622 |
126687902 |
1 |
ON2C11H22 |
AB2C11D22 |
-80.27 |
4.55 |
-8.94 |
1.32 |
0 |
|
|
326623 |
126687907 |
4 |
N2O3C12H18 |
A2B3C12D18 |
-551.48 |
9.16 |
-8.96 |
-0.72 |
0 |
|
|
326624 |
126687908 |
1 |
N7O10C46H69 |
A7B10C46D69 |
-467.59 |
5.28 |
-9.08 |
-0.46 |
0 |
|
|
326625 |
126687910 |
1 |
N8O10C47H72 |
A8B10C47D72 |
-455.17 |
6.31 |
-8.82 |
-0.53 |
0 |
|
|
326626 |
126687911 |
1 |
NOC10H19 |
ABC10D19 |
-55.59 |
3.47 |
-9.1 |
0.51 |
0 |
|
|
326627 |
126687912 |
1 |
IN2H7C9 |
AB2C7D9 |
82.6 |
6.55 |
-9.61 |
-1.41 |
0 |
|
|
326628 |
126687913 |
1 |
IN2H7C9 |
AB2C7D9 |
82.49 |
6.6 |
-9.68 |
-1.44 |
0 |
|
|
326629 |
126687914 |
1 |
N3O3C19H21 |
A3B3C19D21 |
-37.34 |
0.94 |
-8.85 |
-0.54 |
0 |
|
|
326630 |
126687916 |
1 |
SF4O5N9C30H31 |
AB4C5D9E30F31 |
-247.86 |
14.07 |
-8.08 |
-2.25 |
0 |
|
|
326631 |
126687920 |
2 |
INH2C4 |
ABC2D4 |
101.36 |
2.15 |
-9.94 |
-1.8 |
0 |
|
|
326632 |
126687922 |
1 |
IO3C7H11 |
AB3C7D11 |
-133.08 |
2.98 |
-10.14 |
-1.56 |
0 |
|
|
326633 |
126687923 |
1 |
N8O11C47H72 |
A8B11C47D72 |
-510.61 |
6.94 |
-9.25 |
-0.45 |
0 |
|
|
326634 |
126687924 |
1 |
N8O11C47H72 |
A8B11C47D72 |
-498.05 |
5.63 |
-9.05 |
-0.83 |
0 |
|
|
326635 |
126687925 |
1 |
N7O11C49H77 |
A7B11C49D77 |
-529.36 |
4.86 |
-8.96 |
-0.94 |
0 |
|
|
326636 |
126687926 |
1 |
F3N3O3H16C18 |
A3B3C3D16E18 |
-188.65 |
8.34 |
-8.46 |
-0.77 |
0 |
|
|
326637 |
126687928 |
1 |
N8O11C48H74 |
A8B11C48D74 |
-497.98 |
1.57 |
-8.67 |
-0.39 |
0 |
|
|
326638 |
126687929 |
1 |
SN8O13C48H72 |
AB8C13D48E72 |
-594.45 |
4.79 |
-9.18 |
-0.64 |
0 |
|
|
326639 |
126687930 |
1 |
N7O9C43H73 |
A7B9C43D73 |
-463.16 |
12.95 |
-8.92 |
-0.19 |
0 |
|
|
326640 |
126687932 |
1 |
N9O11C48H75 |
A9B11C48D75 |
-501.22 |
5.31 |
-8.8 |
-0.4 |
0 |
|
|
326641 |
126687933 |
1 |
SN9O13C48H73 |
AB9C13D48E73 |
-581.74 |
4.99 |
-8.68 |
-0.61 |
0 |
|
|
326642 |
126687934 |
1 |
N8O11C44H66 |
A8B11C44D66 |
-492.19 |
7.01 |
-9.2 |
-0.71 |
0 |
|
|
326643 |
126687936 |
1 |
N8O11C49H74 |
A8B11C49D74 |
-497.61 |
2.16 |
-8.94 |
-0.44 |
0 |
|
|
326644 |
126687937 |
2 |
N4O6C25H39 |
A4B6C25D39 |
-564.93 |
9.78 |
-9.03 |
-0.39 |
0 |
|
|
326645 |
126687938 |
1 |
N8O13C50H78 |
A8B13C50D78 |
-606.45 |
3.4 |
-9.43 |
-0.69 |
0 |
|
|
326646 |
126687940 |
1 |
N4O5C17H26 |
A4B5C17D26 |
-198.55 |
5.13 |
-9.31 |
0.13 |
0 |
|
|
326647 |
126687941 |
1 |
NO2C12H23 |
AB2C12D23 |
-123.25 |
2.59 |
-9.72 |
0.71 |
0 |
|
|
326648 |
126687943 |
1 |
N10O11C51H76 |
A10B11C51D76 |
-476.78 |
6.62 |
-9.07 |
-0.79 |
0 |
|
|
326649 |
126687944 |
1 |
N3O6C14H27 |
A3B6C14D27 |
-223.06 |
6.49 |
-9.57 |
-0.47 |
0 |
|
|
326650 |
126687946 |
1 |
N5O9C35H51 |
A5B9C35D51 |
-349.34 |
7.41 |
-8.5 |
-0.99 |
0 |
|
|
326651 |
126687947 |
1 |
N8O13C65H82 |
A8B13C65D82 |
-482.11 |
10.05 |
-8.62 |
-0.37 |
0 |
|
|
326652 |
126687949 |
1 |
N8O11C50H62 |
A8B11C50D62 |
-399.71 |
9.41 |
-9.09 |
-0.67 |
0 |
|
|
326653 |
126687952 |
1 |
N8O13C65H82 |
A8B13C65D82 |
-503.35 |
6.15 |
-8.68 |
-0.45 |
0 |
|
|
326654 |
126687953 |
1 |
N8O11C49H60 |
A8B11C49D60 |
-421.64 |
4.01 |
-9.11 |
-0.99 |
0 |
|
|
326655 |
126687954 |
1 |
IN2C5H5 |
AB2C5D5 |
66.73 |
5.23 |
-9.9 |
-1.38 |
0 |
|
|
326656 |
126687955 |
1 |
IN2H7C9 |
AB2C7D9 |
73.35 |
4.3 |
-9.26 |
-1.22 |
0 |
|
|
326657 |
126687957 |
1 |
N7O10C32H41 |
A7B10C32D41 |
-399.46 |
8.95 |
-9.34 |
-1.02 |
0 |
|
|
326658 |
126687959 |
1 |
N9O12C51H77 |
A9B12C51D77 |
-524.59 |
12.27 |
-8.71 |
-0.82 |
0 |
|
|
326659 |
126687960 |
1 |
N9O12C51H77 |
A9B12C51D77 |
-529.37 |
3.68 |
-9.16 |
-0.33 |
0 |
|
|
326660 |
126687961 |
1 |
N10O12C53H80 |
A10B12C53D80 |
-553.08 |
3.87 |
-9.43 |
-1.01 |
0 |
|
|
326661 |
126687962 |
1 |
N10O12C53H80 |
A10B12C53D80 |
-548.74 |
9.64 |
-8.98 |
-0.71 |
0 |
|
|
326662 |
126687963 |
1 |
N6O11C39H46 |
A6B11C39D46 |
-423.21 |
3.31 |
-9.14 |
-0.61 |
0 |
|
|
326663 |
126687965 |
1 |
N8O11C50H62 |
A8B11C50D62 |
-410.73 |
9.32 |
-9.37 |
-0.91 |
0 |
|
|
326664 |
126687966 |
4 |
N2O3C12H18 |
A2B3C12D18 |
-543.77 |
2.1 |
-9.34 |
-0.49 |
0 |
|
|
326665 |
126687968 |
1 |
SN9O13C49H75 |
AB9C13D49E75 |
-592.97 |
3.86 |
-8.97 |
-0.72 |
0 |
|
|
326666 |
126687969 |
1 |
N8O12C47H70 |
A8B12C47D70 |
-541.2 |
8.14 |
-9.4 |
-0.9 |
0 |
|
|
326667 |
126687970 |
1 |
SN9O13C49H75 |
AB9C13D49E75 |
-597.58 |
14.43 |
-9.15 |
-0.65 |
0 |
|
|
326668 |
126687971 |
1 |
N8O11C48H74 |
A8B11C48D74 |
-517.88 |
8.18 |
-9.4 |
-0.86 |
0 |
|
|
326669 |
126687972 |
1 |
N8O11C47H74 |
A8B11C47D74 |
-405.33 |
1.2 |
-9.25 |
-0.87 |
0 |
|
|
326670 |
126687973 |
1 |
N8O12C51H78 |
A8B12C51D78 |
-557.05 |
7.4 |
-9.2 |
-0.45 |
0 |
|
|
326671 |
126687978 |
1 |
F3N4O4H17C26 |
A3B4C4D17E26 |
-151.16 |
1.45 |
-8.92 |
-1.46 |
0 |
|
|
326672 |
126687979 |
1 |
NOC25H29 |
ABC25D29 |
2.55 |
4.43 |
-7.96 |
0.18 |
0 |