List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
327957 |
126691513 |
1 |
F2N3O5C33H39 |
A2B3C5D33E39 |
-211.96 |
3.89 |
-8.63 |
-0.4 |
0 |
|
|
327958 |
126691516 |
1 |
N6O16C75H106 |
A6B16C75D106 |
-498.38 |
24.58 |
-6.75 |
-2.41 |
0 |
|
|
327959 |
126691531 |
1 |
N3S3O13C38H45 |
A3B3C13D38E45 |
-410.76 |
4.37 |
-8.32 |
-1.35 |
0 |
|
|
327960 |
126691532 |
1 |
S2N3O10C40H49 |
A2B3C10D40E49 |
-371.34 |
11.1 |
-7.96 |
-1.1 |
0 |
|
|
327961 |
126691533 |
1 |
N3S3O13C38H45 |
A3B3C13D38E45 |
-409.51 |
9.2 |
-8.4 |
-1.4 |
0 |
|
|
327962 |
126691537 |
1 |
N3C5H11 |
A3B5C11 |
20.36 |
2.82 |
-8.28 |
0.72 |
0 |
|
|
327963 |
126691538 |
2 |
O2N7C21H25 |
A2B7C21D25 |
10.45 |
2.49 |
-8.56 |
-1.04 |
0 |
|
|
327964 |
126691539 |
1 |
S2N3O7C32H43 |
A2B3C7D32E43 |
-246.22 |
1.91 |
-7.83 |
-0.67 |
0 |
|
|
327965 |
126691546 |
1 |
O3N4F7H23C27 |
A3B4C7D23E27 |
-391.73 |
6.69 |
-9.11 |
-1.22 |
0 |
|
|
327966 |
126691548 |
1 |
ON2C26H30 |
AB2C26D30 |
14.66 |
5.23 |
-8.35 |
-0.05 |
0 |
|
|
327967 |
126691550 |
1 |
FSO2N4C23H23 |
ABC2D4E23F23 |
-36.8 |
5.14 |
-8.52 |
-0.77 |
0 |
|
|
327968 |
126691554 |
1 |
N3O4F6C33H33 |
A3B4C6D33E33 |
-418.96 |
2.71 |
-8.66 |
-1.33 |
0 |
|
|
327969 |
126691562 |
1 |
N3O3F6H31C32 |
A3B3C6D31E32 |
-353.97 |
3.06 |
-8.6 |
-1.3 |
0 |
|
|
327970 |
126691565 |
1 |
N3O5F6C35H35 |
A3B5C6D35E35 |
-468.19 |
11.81 |
-8.69 |
-1.46 |
0 |
|
|
327972 |
126691574 |
1 |
N5O5F6H25C34 |
A5B5C6D25E34 |
-375.83 |
10.57 |
-9.54 |
-1.81 |
0 |
|
|
327973 |
126691579 |
1 |
N3O4F6C31H31 |
A3B4C6D31E31 |
-413.94 |
3.73 |
-8.66 |
-1.32 |
0 |
|
|
327974 |
126691582 |
1 |
O3N4F6H32C34 |
A3B4C6D32E34 |
-337.98 |
5.72 |
-8.21 |
-1.27 |
0 |
|
|
327975 |
126691592 |
1 |
N3O5F6C34H37 |
A3B5C6D34E37 |
-472.31 |
4.13 |
-8.35 |
-1.2 |
0 |
|
|
327976 |
126691595 |
1 |
ClOSC4N5H6 |
ABCD4E5F6 |
52.6 |
2.22 |
-9.73 |
-1.32 |
0 |
|
|
327977 |
126691603 |
1 |
FON2C15H17 |
ABC2D15E17 |
-37.89 |
5.24 |
-7.98 |
0.0 |
0 |
|
|
327978 |
126691611 |
1 |
N3O5F6H33C34 |
A3B5C6D33E34 |
-460.9 |
7.38 |
-8.82 |
-1.29 |
0 |
|
|
327979 |
126691613 |
1 |
N3F5O5H30C35 |
A3B5C5D30E35 |
-360.78 |
8.91 |
-8.99 |
-1.0 |
0 |
|
|
327980 |
126691614 |
1 |
N3O5F6H31C36 |
A3B5C6D31E36 |
-423.68 |
5.9 |
-8.65 |
-1.35 |
0 |
|
|
327981 |
126691616 |
2 |
OC9H10 |
AB9C10 |
-65.21 |
1.74 |
-8.7 |
0.17 |
0 |
|
|
327982 |
126691617 |
1 |
F2N3O3H25C26 |
A2B3C3D25E26 |
-128.8 |
5.95 |
-8.78 |
-0.61 |
0 |
|
|
327983 |
126691622 |
1 |
SN4C14H16 |
AB4C14D16 |
103.31 |
4.23 |
-7.5 |
-1.02 |
-1 |
|
|
327984 |
126691628 |
1 |
N2S2O9C34H35 |
A2B2C9D34E35 |
-270.54 |
11.44 |
0.0 |
0.0 |
0 |
|
|
327985 |
126691631 |
1 |
N2S3O12C32H36 |
A2B3C12D32E36 |
-364.45 |
2.33 |
-8.19 |
-1.05 |
0 |
|
|
327986 |
126691634 |
1 |
N4O5F8H26C31 |
A4B5C8D26E31 |
-517.77 |
7.87 |
-9.15 |
-1.47 |
0 |
|
|
327987 |
126691635 |
1 |
N3O5F6C35H37 |
A3B5C6D35E37 |
-459.54 |
8.08 |
-8.63 |
-1.21 |
0 |
|
|
327988 |
126691636 |
1 |
N3O3F6H25C28 |
A3B3C6D25E28 |
-357.21 |
7.35 |
-8.95 |
-1.21 |
0 |
|
|
327989 |
126691638 |
1 |
N3O4F6H31C33 |
A3B4C6D31E33 |
-381.38 |
7.06 |
-8.68 |
-1.44 |
0 |
|
|
327990 |
126691639 |
1 |
N3O4C35H41 |
A3B4C35D41 |
-81.48 |
8.96 |
-8.61 |
-0.24 |
1 |
|
|
327991 |
126691645 |
1 |
PF2N3O5C29H33 |
AB2C3D5E29F33 |
-273.77 |
4.98 |
0.0 |
0.0 |
0 |
|
|
327992 |
126691646 |
1 |
N3O5F6H33C34 |
A3B5C6D33E34 |
-452.96 |
10.66 |
-8.73 |
-1.46 |
0 |
|
|
327993 |
126691653 |
1 |
F4N4O5H30C36 |
A4B4C5D30E36 |
-280.01 |
11.99 |
-9.04 |
-1.47 |
0 |
|
|
327994 |
126691655 |
1 |
FOSH11C14 |
ABCD11E14 |
-25.84 |
4.13 |
-9.24 |
-1.09 |
0 |
|
|
327995 |
126691656 |
1 |
O3F6N7H29C30 |
A3B6C7D29E30 |
-288.33 |
3.05 |
-8.75 |
-1.36 |
0 |
|
|
327996 |
126691660 |
1 |
ClFN4H14C17 |
ABC4D14E17 |
37.06 |
4.63 |
-9.51 |
-1.29 |
0 |
|
|
327997 |
126691663 |
3 |
NF2O2H11C12 |
AB2C2D11E12 |
-448.12 |
9.94 |
-8.99 |
-1.22 |
0 |
|
|
327998 |
126691666 |
1 |
SN4O5C27H32 |
AB4C5D27E32 |
-144.87 |
14.77 |
-8.25 |
-0.43 |
0 |
|
|
327999 |
126691670 |
1 |
N3O5F6H33C34 |
A3B5C6D33E34 |
-449.06 |
11.63 |
-8.67 |
-1.42 |
0 |
|
|
328000 |
126691671 |
1 |
N2O3C19H24 |
A2B3C19D24 |
-100.09 |
5.09 |
-8.35 |
-0.06 |
0 |
|
|
328001 |
126691672 |
2 |
N2F3O3C16H17 |
A2B3C3D16E17 |
-485.7 |
8.55 |
-8.76 |
-1.17 |
0 |
|
|
328002 |
126691682 |
1 |
N3O3F6H25C28 |
A3B3C6D25E28 |
-356.7 |
7.18 |
-8.99 |
-1.23 |
0 |
|
|
328003 |
126691685 |
1 |
F2N3O5C33H37 |
A2B3C5D33E37 |
-247.91 |
6.76 |
-8.83 |
-0.38 |
0 |
|
|
328004 |
126691686 |
1 |
F2N3O5C33H35 |
A2B3C5D33E35 |
-241.45 |
6.18 |
-8.62 |
-0.47 |
0 |
|
|
328005 |
126691687 |
1 |
SN2O2C10H18 |
AB2C2D10E18 |
-99.95 |
3.31 |
-8.37 |
0.53 |
0 |
|
|
328006 |
126691713 |
1 |
O3N4F6C33H34 |
A3B4C6D33E34 |
-370.33 |
6.28 |
-8.85 |
-1.22 |
0 |
|
|
328007 |
126691717 |
1 |
N5O5F9H28C35 |
A5B5C9D28E35 |
-548.69 |
8.39 |
-9.28 |
-1.39 |
0 |
|
|
328008 |
126691719 |
1 |
N3O3F6H23C27 |
A3B3C6D23E27 |
-340.93 |
5.92 |
-9.14 |
-1.02 |
0 |
|
|
328009 |
126691725 |
1 |
N3F4O5C35H37 |
A3B4C5D35E37 |
-361.52 |
10.74 |
-8.72 |
-1.19 |
0 |
|
|
328010 |
126691726 |
2 |
N3O6C27H43 |
A3B6C27D43 |
-382.27 |
21.26 |
-6.68 |
-3.63 |
0 |
|
|
328011 |
126691727 |
2 |
N2F3O3H16C18 |
A2B3C3D16E18 |
-470.11 |
9.4 |
-9.08 |
-1.44 |
0 |
|
|
328012 |
126691729 |
2 |
N3O6C27H43 |
A3B6C27D43 |
-376.17 |
18.4 |
-8.32 |
-0.76 |
0 |
|
|
328013 |
126691733 |
1 |
N5O5F6H31C35 |
A5B5C6D31E35 |
-388.47 |
7.41 |
-9.57 |
-1.55 |
0 |
|
|
328014 |
126691737 |
1 |
N9O13C67H97 |
A9B13C67D97 |
-407.54 |
11.28 |
-8.48 |
-0.84 |
0 |
|
|
328015 |
126691738 |
1 |
N9O13C67H97 |
A9B13C67D97 |
-374.31 |
22.11 |
-6.65 |
-2.24 |
0 |
|
|
328016 |
126691742 |
1 |
SF3N4O13C68H91 |
AB3C4D13E68F91 |
-576.33 |
15.7 |
-8.48 |
-1.18 |
0 |
|
|
328017 |
126691753 |
1 |
ClN7O14C71H100 |
AB7C14D71E100 |
-484.5 |
9.88 |
-8.31 |
-0.91 |
0 |
|
|
328018 |
126691760 |
1 |
N3O4F6C33H33 |
A3B4C6D33E33 |
-391.63 |
4.37 |
-8.44 |
-1.31 |
0 |
|
|
328019 |
126691761 |
1 |
N3O5F8H27C31 |
A3B5C8D27E31 |
-573.54 |
11.35 |
-9.31 |
-1.11 |
0 |
|
|
328020 |
126691762 |
1 |
BrFOC11H12 |
ABCD11E12 |
-84.98 |
3.4 |
-9.6 |
-0.4 |
0 |
|
|
328021 |
126691764 |
1 |
BrFN3C6H9 |
ABC3D6E9 |
-17.86 |
3.45 |
-8.85 |
-1.11 |
0 |
|
|
328022 |
126691770 |
1 |
FN4O5C29H31 |
AB4C5D29E31 |
-155.5 |
6.74 |
-8.77 |
-0.54 |
0 |
|
|
328023 |
126691773 |
1 |
N3O5F7H32C37 |
A3B5C7D32E37 |
-480.31 |
7.97 |
-9.07 |
-1.35 |
0 |
|
|
328024 |
126691774 |
1 |
F3N3O5C34H36 |
A3B3C5D34E36 |
-306.09 |
6.0 |
-8.36 |
-0.64 |
0 |
|
|
328025 |
126691779 |
1 |
N3O5F8H27C32 |
A3B5C8D27E32 |
-522.82 |
7.25 |
-9.06 |
-1.46 |
0 |
|
|
328026 |
126691781 |
1 |
N3O5F6H31C32 |
A3B5C6D31E32 |
-434.85 |
3.22 |
-8.65 |
-1.15 |
0 |
|
|
328027 |
126691783 |
1 |
N3O3F6H29C31 |
A3B3C6D29E31 |
-342.27 |
5.72 |
-8.62 |
-1.25 |
-1 |
|
|
328028 |
126691786 |
1 |
N2S2O8C32H35 |
A2B2C8D32E35 |
-230.53 |
5.22 |
0.0 |
0.0 |
0 |
|
|
328029 |
126691795 |
1 |
N4O4C35H42 |
A4B4C35D42 |
-118.51 |
4.46 |
-8.5 |
-0.04 |
0 |
|
|
328030 |
126691799 |
1 |
N4O5F6H28C31 |
A4B5C6D28E31 |
-416.41 |
9.11 |
-8.98 |
-1.4 |
0 |
|
|
328031 |
126691800 |
1 |
OSN3C16H25 |
ABC3D16E25 |
47.32 |
4.31 |
-8.1 |
-0.25 |
0 |
|
|
328032 |
126691801 |
1 |
F2N3O3C29H29 |
A2B3C3D29E29 |
-111.25 |
2.94 |
-8.56 |
-0.58 |
0 |