List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
313712 |
126617314 |
1 |
SO2N5H23C27 |
AB2C5D23E27 |
79.69 |
7.11 |
-8.74 |
-1.19 |
0 |
|
|
313713 |
126617316 |
1 |
ClFSO3N5H17C20 |
ABCD3E5F17G20 |
-66.59 |
7.01 |
-8.84 |
-1.31 |
0 |
|
|
313714 |
126617317 |
1 |
ClFSO3N5H17C20 |
ABCD3E5F17G20 |
-69.5 |
6.1 |
-8.89 |
-1.34 |
0 |
|
|
313715 |
126617318 |
1 |
SO2N5C13H13 |
AB2C5D13E13 |
3.82 |
7.84 |
-8.86 |
-1.27 |
0 |
|
|
313716 |
126617319 |
1 |
SO2N5C13H13 |
AB2C5D13E13 |
3.3 |
6.67 |
-9.06 |
-1.34 |
0 |
|
|
313717 |
126617320 |
1 |
SO4N5H11C13 |
AB4C5D11E13 |
-71.79 |
4.85 |
-9.14 |
-1.9 |
0 |
|
|
313718 |
126617321 |
1 |
ClSO3N5H16C19 |
ABC3D5E16F19 |
-15.12 |
8.19 |
-8.98 |
-1.39 |
0 |
|
|
313719 |
126617326 |
1 |
SO2N5C15H15 |
AB2C5D15E15 |
7.04 |
8.42 |
-8.86 |
-1.21 |
0 |
|
|
313720 |
126617328 |
1 |
SO2N7C25H29 |
AB2C7D25E29 |
40.88 |
7.76 |
-8.67 |
-1.06 |
0 |
|
|
313721 |
126617330 |
1 |
ON7C22H23 |
AB7C22D23 |
96.05 |
6.09 |
-8.41 |
-1.56 |
0 |
|
|
313722 |
126617338 |
1 |
SO2N6C25H28 |
AB2C6D25E28 |
28.16 |
7.39 |
-8.79 |
-1.15 |
0 |
|
|
313723 |
126617339 |
1 |
ClFSO2N6C26H30 |
ABCD2E6F26G30 |
-41.16 |
6.7 |
-8.65 |
-1.33 |
0 |
|
|
313724 |
126617340 |
1 |
SO2N5H23C30 |
AB2C5D23E30 |
87.43 |
6.75 |
-8.68 |
-1.26 |
0 |
|
|
313725 |
126617341 |
1 |
ClFO2N5H11C18 |
ABC2D5E11F18 |
-0.51 |
2.93 |
-9.54 |
-1.82 |
0 |
|
|
313726 |
126617343 |
1 |
ClFSO2N5H19C21 |
ABCD2E5F19G21 |
-25.37 |
7.84 |
-8.64 |
-1.23 |
0 |
|
|
313727 |
126617344 |
1 |
ClFSO2N4H10C17 |
ABCD2E4F10G17 |
-8.7 |
4.48 |
-9.25 |
-1.52 |
0 |
|
|
313728 |
126617346 |
1 |
ClFSO3N6H22C23 |
ABCD3E6F22G23 |
-56.77 |
6.82 |
-8.99 |
-1.35 |
0 |
|
|
313729 |
126617350 |
1 |
ClFSO2N6H24C28 |
ABCD2E6F24G28 |
12.33 |
6.36 |
-8.92 |
-1.33 |
0 |
|
|
313730 |
126617352 |
1 |
O2N5H17C23 |
A2B5C17D23 |
83.37 |
4.75 |
-8.97 |
-1.63 |
0 |
|
|
313731 |
126617354 |
1 |
SO3N5H15C20 |
AB3C5D15E20 |
21.46 |
6.92 |
-8.89 |
-1.51 |
0 |
|
|
313732 |
126617355 |
1 |
ClFSO3N6C25H26 |
ABCD3E6F25G26 |
-69.68 |
7.44 |
-9.07 |
-1.41 |
0 |
|
|
313733 |
126617358 |
1 |
SO3N5H17C21 |
AB3C5D17E21 |
14.32 |
9.18 |
-8.9 |
-1.49 |
0 |
|
|
313734 |
126617359 |
1 |
FSO2N6C23H23 |
ABC2D6E23F23 |
-14.91 |
5.66 |
-8.92 |
-1.23 |
0 |
|
|
313735 |
126617363 |
1 |
ClFSO4N5H17C20 |
ABCD4E5F17G20 |
-102.83 |
9.46 |
-9.15 |
-1.52 |
0 |
|
|
313736 |
126617367 |
1 |
ON8C18H18 |
AB8C18D18 |
101.57 |
8.1 |
-8.53 |
-1.42 |
0 |
|
|
313737 |
126617368 |
1 |
SO3N5C21H21 |
AB3C5D21E21 |
-23.87 |
10.2 |
-8.87 |
-1.27 |
0 |
|
|
313738 |
126617369 |
1 |
ClON6H11C16 |
ABC6D11E16 |
86.85 |
5.02 |
-8.85 |
-1.6 |
0 |
|
|
313739 |
126617371 |
1 |
SCl2O3N5H15C19 |
AB2C3D5E15F19 |
-22.04 |
8.18 |
-8.96 |
-1.38 |
0 |
|
|
313740 |
126617376 |
1 |
ClFSO2N6C22H22 |
ABCD2E6F22G22 |
-19.79 |
7.71 |
-8.9 |
-1.32 |
0 |
|
|
313741 |
126617377 |
1 |
ON9C19H21 |
AB9C19D21 |
109.88 |
8.72 |
-8.52 |
-1.42 |
0 |
|
|
313742 |
126617386 |
1 |
ClFSO2N5H11C17 |
ABCD2E5F11G17 |
-14.17 |
5.08 |
-9.06 |
-1.4 |
0 |
|
|
313743 |
126617388 |
2 |
ON3H7C9 |
AB3C7D9 |
55.12 |
4.09 |
-8.89 |
-1.64 |
0 |
|
|
313744 |
126617391 |
1 |
SO3N5H23C26 |
AB3C5D23E26 |
12.65 |
9.63 |
-8.87 |
-1.29 |
0 |
|
|
313745 |
126617393 |
1 |
FON6H11C16 |
ABC6D11E16 |
49.26 |
4.8 |
-8.82 |
-1.57 |
0 |
|
|
313746 |
126617394 |
1 |
SO2N5C13H13 |
AB2C5D13E13 |
1.51 |
7.06 |
-8.93 |
-1.31 |
0 |
|
|
313747 |
126617396 |
1 |
FSO2Cl3N5H17C25 |
ABC2D3E5F17G25 |
-3.39 |
8.54 |
-9.07 |
-1.34 |
0 |
|
|
313748 |
126617403 |
1 |
FSO2N6H27C29 |
ABC2D6E27F29 |
13.46 |
8.22 |
-8.85 |
-1.33 |
0 |
|
|
313749 |
126617405 |
1 |
ClNO5C35H38 |
ABC5D35E38 |
-159.4 |
4.94 |
-8.7 |
-0.35 |
0 |
|
|
313750 |
126617407 |
1 |
SO4N5H19C20 |
AB4C5D19E20 |
-44.85 |
10.01 |
-8.91 |
-1.24 |
0 |
|
|
313751 |
126617417 |
1 |
ON7C21H21 |
AB7C21D21 |
90.52 |
8.43 |
-8.6 |
-1.44 |
0 |
|
|
313752 |
126617420 |
1 |
OSN6C21H22 |
ABC6D21E22 |
70.36 |
8.84 |
-8.74 |
-1.09 |
0 |
|
|
313753 |
126617421 |
1 |
SF2O3N5H15C19 |
AB2C3D5E15F19 |
-93.67 |
9.97 |
-9.05 |
-1.41 |
0 |
|
|
313754 |
126617422 |
1 |
SO2N5C13H13 |
AB2C5D13E13 |
15.01 |
9.53 |
-8.84 |
-1.26 |
0 |
|
|
313755 |
126617423 |
1 |
ON5H13C17 |
AB5C13D17 |
90.71 |
8.07 |
-9.24 |
-1.05 |
0 |
|
|
313756 |
126617430 |
1 |
ON7H11C15 |
AB7C11D15 |
107.59 |
5.01 |
-8.86 |
-1.61 |
0 |
|
|
313757 |
126617433 |
1 |
O2N5H11C12 |
A2B5C11D12 |
18.83 |
6.38 |
-9.34 |
-1.19 |
0 |
|
|
313758 |
126617434 |
1 |
FN2O3C35H35 |
AB2C3D35E35 |
-117.63 |
3.01 |
-8.83 |
-0.45 |
0 |
|
|
313759 |
126617438 |
1 |
O3N5H19C24 |
A3B5C19D24 |
42.37 |
3.59 |
-8.95 |
-1.65 |
0 |
|
|
313760 |
126617471 |
1 |
ClO2F3N4C28H30 |
AB2C3D4E28F30 |
-204.38 |
6.93 |
-9.82 |
-1.21 |
0 |
|
|
313761 |
126617474 |
1 |
OCl3N4C20H21 |
AB3C4D20E21 |
-6.58 |
2.6 |
-9.52 |
-1.4 |
0 |
|
|
313762 |
126617478 |
1 |
Cl2O2F3N4H23C24 |
A2B2C3D4E23F24 |
-201.17 |
8.57 |
-9.84 |
-1.22 |
0 |
|
|
313763 |
126617480 |
1 |
ClF3O3N5C25H27 |
AB3C3D5E25F27 |
-233.69 |
7.74 |
-9.68 |
-1.18 |
0 |
|
|
313764 |
126617482 |
1 |
ClON3C14H14 |
ABC3D14E14 |
41.19 |
1.32 |
-9.68 |
-1.28 |
0 |
|
|
313765 |
126617486 |
1 |
ClO2F3N4C26H26 |
AB2C3D4E26F26 |
-192.15 |
7.71 |
-9.75 |
-1.18 |
0 |
|
|
313766 |
126617487 |
1 |
ClO4N5C26H32 |
AB4C5D26E32 |
-115.97 |
7.0 |
-9.75 |
-1.13 |
0 |
|
|
313767 |
126617489 |
1 |
O3C14H20 |
A3B14C20 |
-122.31 |
2.33 |
-9.56 |
0.11 |
0 |
|
|
313768 |
126617520 |
1 |
FO2N5C20H20 |
AB2C5D20E20 |
-40.72 |
3.36 |
-8.82 |
-1.12 |
0 |
|
|
313769 |
126617524 |
1 |
O3N4C22H28 |
A3B4C22D28 |
-90.1 |
2.21 |
-8.67 |
-0.59 |
0 |
|
|
313770 |
126617532 |
1 |
NPSF3O5C10H11 |
ABCD3E5F10G11 |
-349.17 |
2.64 |
-9.34 |
-1.9 |
0 |
|
|
313771 |
126617535 |
1 |
PN4O4C15H17 |
AB4C4D15E17 |
-104.32 |
1.83 |
-9.22 |
-1.04 |
0 |
|
|
313772 |
126617536 |
1 |
PO3N4C14H15 |
AB3C4D14E15 |
-71.28 |
3.4 |
-9.31 |
-1.21 |
0 |
|
|
313773 |
126617544 |
1 |
FO3N4C21H25 |
AB3C4D21E25 |
-124.48 |
5.19 |
-8.58 |
-0.59 |
0 |
|
|
313774 |
126617545 |
1 |
FO3N4C21H25 |
AB3C4D21E25 |
-130.41 |
5.96 |
-8.83 |
-0.78 |
0 |
|
|
313775 |
126617546 |
1 |
NSC12H25 |
ABC12D25 |
17.46 |
4.67 |
-8.94 |
-0.54 |
0 |
|
|
313776 |
126617567 |
1 |
FS2N4O7C28H31 |
AB2C4D7E28F31 |
-251.75 |
11.33 |
-9.05 |
-0.68 |
0 |
|
|
313777 |
126617573 |
1 |
SN3O6C18H21 |
AB3C6D18E21 |
-216.4 |
10.23 |
-9.49 |
-0.99 |
0 |
|
|
313778 |
126617576 |
1 |
ClSF2O5N6H27C30 |
ABC2D5E6F27G30 |
-189.75 |
7.37 |
-8.95 |
-1.26 |
0 |
|
|
313779 |
126617577 |
1 |
FSN4O6C30H33 |
ABC4D6E30F33 |
-229.86 |
9.33 |
-9.35 |
-1.0 |
0 |
|
|
313780 |
126617578 |
1 |
ClSF2N4O6H27C28 |
ABC2D4E6F27G28 |
-272.66 |
6.55 |
-9.3 |
-0.93 |
0 |
|
|
313781 |
126617579 |
1 |
ClSF2N5O5H20C26 |
ABC2D5E5F20G26 |
-184.94 |
10.41 |
-9.06 |
-1.25 |
0 |
|
|
313782 |
126617580 |
1 |
FSN4O6C31H35 |
ABC4D6E31F35 |
-236.53 |
9.66 |
-9.3 |
-0.99 |
0 |
|
|
313783 |
126617592 |
1 |
SO4N5C12H15 |
AB4C5D12E15 |
-103.62 |
5.99 |
-9.37 |
-1.11 |
0 |
|
|
313784 |
126617635 |
1 |
FO4N5H24C31 |
AB4C5D24E31 |
-59.85 |
11.14 |
-8.45 |
-1.0 |
0 |
|
|
313785 |
126617678 |
1 |
FN4O6C33H33 |
AB4C6D33E33 |
-178.11 |
13.86 |
-8.4 |
-0.87 |
0 |
|
|
313786 |
126617703 |
2 |
ON3H6C8 |
AB3C6D8 |
51.34 |
8.07 |
-8.94 |
-1.83 |
0 |