List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
131607 |
51234469 |
1 |
SO2N5C19H27 |
AB2C5D19E27 |
-22.36 |
6.67 |
-9.1 |
-0.37 |
0 |
|
|
131608 |
51234470 |
1 |
FOSN5C18H24 |
ABCD5E18F24 |
-29.78 |
5.51 |
-9.2 |
-0.51 |
0 |
|
|
131609 |
51234514 |
1 |
SO2N4C16H18 |
AB2C4D16E18 |
8.43 |
4.09 |
-8.78 |
-0.57 |
0 |
|
|
131610 |
51234529 |
1 |
OS2N3C15H17 |
AB2C3D15E17 |
17.72 |
2.15 |
-8.82 |
-1.16 |
0 |
|
|
131611 |
51234660 |
1 |
SO2N5C20H23 |
AB2C5D20E23 |
24.44 |
4.34 |
-9.0 |
-1.03 |
0 |
|
|
131612 |
51235073 |
1 |
OS2N5C13H19 |
AB2C5D13E19 |
28.06 |
5.42 |
-8.82 |
-1.21 |
0 |
|
|
131613 |
51235215 |
1 |
SO2N3C20H29 |
AB2C3D20E29 |
-89.25 |
5.11 |
-9.0 |
-0.87 |
0 |
|
|
131614 |
51235216 |
1 |
SO3N4C19H26 |
AB3C4D19E26 |
-134.92 |
1.36 |
-9.05 |
-0.9 |
0 |
|
|
131615 |
51235483 |
1 |
OS2N6C17H22 |
AB2C6D17E22 |
45.6 |
6.98 |
-8.79 |
-1.31 |
0 |
|
|
131616 |
51235484 |
1 |
SO2F3N5C14H20 |
AB2C3D5E14F20 |
-219.58 |
4.89 |
-8.75 |
-0.61 |
0 |
|
|
131617 |
51235937 |
1 |
O2S3N4C15H18 |
A2B3C4D15E18 |
-23.16 |
7.29 |
-8.7 |
-1.38 |
0 |
|
|
131618 |
51236031 |
1 |
OS2N4C16H20 |
AB2C4D16E20 |
33.32 |
4.35 |
-8.77 |
-1.07 |
0 |
|
|
131619 |
51236032 |
2 |
OSN2C8H10 |
ABC2D8E10 |
0.16 |
7.22 |
-8.11 |
-1.13 |
0 |
|
|
131620 |
51236055 |
1 |
O2S2N5C12H15 |
A2B2C5D12E15 |
43.42 |
8.71 |
-8.54 |
-0.62 |
0 |
|
|
131621 |
51236213 |
1 |
OSN3C16H21 |
ABC3D16E21 |
3.91 |
3.23 |
-8.78 |
-0.59 |
0 |
|
|
131622 |
51236214 |
1 |
SO2N5H19C20 |
AB2C5D19E20 |
8.34 |
7.5 |
-8.54 |
-0.74 |
0 |
|
|
131623 |
51236215 |
1 |
SO2N4C17H18 |
AB2C4D17E18 |
34.95 |
2.25 |
-8.52 |
-0.22 |
0 |
|
|
131624 |
51236234 |
2 |
OSN2C9H13 |
ABC2D9E13 |
-33.87 |
4.31 |
-8.46 |
-1.0 |
0 |
|
|
131625 |
51236696 |
1 |
N2S2O3C15H18 |
A2B2C3D15E18 |
-70.55 |
7.64 |
-9.33 |
-0.86 |
0 |
|
|
131626 |
51236697 |
1 |
N2S2O3C16H20 |
A2B2C3D16E20 |
-80.38 |
8.05 |
-9.25 |
-0.76 |
0 |
|
|
131627 |
51236769 |
1 |
ClO2S2N4C14H17 |
AB2C2D4E14F17 |
-24.11 |
9.01 |
-8.42 |
-1.12 |
0 |
|
|
131628 |
51236840 |
4 |
NSC3H3 |
ABC3D3 |
117.84 |
3.14 |
-8.51 |
-1.15 |
0 |
|
|
131629 |
51236841 |
1 |
OS3N5C14H17 |
AB3C5D14E17 |
24.95 |
4.01 |
-8.6 |
-1.12 |
0 |
|
|
131630 |
51236842 |
1 |
OS2N4C16H22 |
AB2C4D16E22 |
10.51 |
5.07 |
-8.67 |
-0.96 |
0 |
|
|
131631 |
51236843 |
1 |
ClOS2N4C14H17 |
ABC2D4E14F17 |
14.72 |
4.82 |
-9.07 |
-1.14 |
0 |
|
|
131632 |
51236844 |
1 |
O2S2N3C13H15 |
A2B2C3D13E15 |
-12.42 |
2.41 |
-8.61 |
-0.89 |
0 |
|
|
131633 |
51236845 |
2 |
OSN2C9H12 |
ABC2D9E12 |
-32.68 |
6.9 |
-8.53 |
-0.83 |
0 |
|
|
131634 |
51236846 |
1 |
O2S2N5C16H25 |
A2B2C5D16E25 |
-51.12 |
8.1 |
-8.91 |
-0.97 |
0 |
|
|
131635 |
51236847 |
1 |
S2O3N5C16H21 |
A2B3C5D16E21 |
-53.74 |
8.23 |
-8.53 |
-0.98 |
0 |
|
|
131636 |
51236848 |
1 |
S2O3N4C16H20 |
A2B3C4D16E20 |
-49.98 |
5.53 |
-8.67 |
-0.91 |
0 |
|
|
131637 |
51237276 |
1 |
S2O3N4C17H22 |
A2B3C4D17E22 |
-78.82 |
4.8 |
-8.63 |
-0.86 |
0 |
|
|
131638 |
51237682 |
1 |
N3O3C22H23 |
A3B3C22D23 |
-33.1 |
8.7 |
-8.52 |
-0.63 |
0 |
|
|
131639 |
51237940 |
1 |
SO3N4C16H20 |
AB3C4D16E20 |
-55.29 |
2.96 |
-8.67 |
-0.83 |
0 |
|
|
131640 |
51237941 |
1 |
ClON5C15H20 |
ABC5D15E20 |
31.76 |
4.5 |
-8.56 |
-0.32 |
0 |
|
|
131641 |
51237942 |
1 |
O2N4C11H12 |
A2B4C11D12 |
-15.83 |
5.22 |
-8.89 |
-0.17 |
0 |
|
|
131642 |
51238108 |
1 |
ClNSO3C16H16 |
ABCD3E16F16 |
-82.44 |
3.34 |
-8.84 |
-1.09 |
0 |
|
|
131643 |
51238109 |
1 |
BrNSO3C16H16 |
ABCD3E16F16 |
-70.0 |
2.45 |
-8.86 |
-1.1 |
0 |
|
|
131644 |
51238110 |
1 |
NSO3H19C20 |
ABC3D19E20 |
-56.6 |
5.34 |
-8.78 |
-1.14 |
0 |
|
|
131645 |
51238111 |
1 |
NSO3C16H17 |
ABC3D16E17 |
-72.65 |
4.96 |
-8.8 |
-0.73 |
0 |
|
|
131646 |
51238223 |
1 |
NSF3O3C15H16 |
ABC3D3E15F16 |
-256.04 |
5.61 |
-9.8 |
-1.23 |
0 |
|
|
131647 |
51238364 |
1 |
SN2O4C18H24 |
AB2C4D18E24 |
-160.06 |
5.58 |
-9.17 |
0.11 |
0 |
|
|
131648 |
51238626 |
1 |
N3O3C19H19 |
A3B3C19D19 |
-24.73 |
2.0 |
-8.8 |
-0.47 |
0 |
|
|
131649 |
51238746 |
1 |
S2N3O3C13H17 |
A2B3C3D13E17 |
-94.82 |
4.87 |
-9.25 |
-0.81 |
0 |
|
|
131650 |
51238856 |
2 |
N2O2C10H13 |
A2B2C10D13 |
-133.99 |
2.7 |
-9.45 |
-0.98 |
0 |
|
|
131651 |
51238857 |
1 |
N3O3C19H25 |
A3B3C19D25 |
-118.96 |
1.17 |
-8.62 |
-0.13 |
0 |
|
|
131652 |
51238858 |
1 |
N2O4C17H22 |
A2B4C17D22 |
-162.16 |
3.67 |
-9.15 |
-0.09 |
0 |
|
|
131653 |
51239054 |
1 |
ON4C19H28 |
AB4C19D28 |
1.63 |
2.2 |
-8.45 |
-0.08 |
0 |
|
|
131654 |
51239139 |
1 |
FN3O3C21H24 |
AB3C3D21E24 |
-125.08 |
3.26 |
-8.52 |
-0.55 |
0 |
|
|
131655 |
51239140 |
1 |
N3O4C19H23 |
A3B4C19D23 |
-103.69 |
2.47 |
-8.46 |
-0.41 |
0 |
|
|
131656 |
51239446 |
1 |
NSO3C20H25 |
ABC3D20E25 |
-97.96 |
3.58 |
-8.83 |
-0.18 |
0 |
|
|
131657 |
51239586 |
1 |
SN2O4C21H22 |
AB2C4D21E22 |
-111.8 |
4.58 |
-9.25 |
-1.7 |
0 |
|
|
131658 |
51239658 |
1 |
SN2O3C19H20 |
AB2C3D19E20 |
-76.98 |
4.46 |
-8.83 |
-0.41 |
0 |
|
|
131659 |
51239659 |
1 |
N2S2O4C17H20 |
A2B2C4D17E20 |
-82.94 |
6.9 |
-9.18 |
-0.94 |
0 |
|
|
131660 |
51239866 |
1 |
S2N3O3C17H21 |
A2B3C3D17E21 |
-53.18 |
8.83 |
-9.33 |
-1.36 |
0 |
|
|
131661 |
51239976 |
2 |
NOC12H12 |
ABC12D12 |
-29.41 |
5.51 |
-9.11 |
-0.75 |
0 |
|
|
131662 |
51239977 |
1 |
N2O2C21H24 |
A2B2C21D24 |
-57.13 |
5.09 |
-8.82 |
-0.42 |
0 |
|
|
131663 |
51240048 |
1 |
SN2O3C16H20 |
AB2C3D16E20 |
-96.03 |
3.17 |
-8.8 |
-0.36 |
0 |
|
|
131664 |
51240049 |
1 |
N3O3C16H19 |
A3B3C16D19 |
-64.95 |
3.5 |
-9.65 |
-0.99 |
0 |
|
|
131665 |
51240050 |
1 |
N3O4C19H23 |
A3B4C19D23 |
-105.88 |
2.15 |
-9.09 |
-1.08 |
0 |
|
|
131666 |
51240051 |
1 |
O4N5C19H21 |
A4B5C19D21 |
-59.72 |
3.33 |
-8.71 |
-1.06 |
0 |
|
|
131667 |
51240264 |
1 |
ClSN2O3C15H21 |
ABC2D3E15F21 |
-128.1 |
7.23 |
-9.2 |
-0.09 |
0 |
|
|
131668 |
51240284 |
1 |
N3O5C19H19 |
A3B5C19D19 |
-87.19 |
13.14 |
-9.01 |
-1.12 |
0 |
|
|
131669 |
51240781 |
1 |
SO4N5C17H19 |
AB4C5D17E19 |
-102.55 |
3.39 |
-9.35 |
-1.29 |
0 |
|
|
131670 |
51240782 |
1 |
N4O4H16C17 |
A4B4C16D17 |
-63.21 |
2.49 |
-9.14 |
-1.09 |
0 |
|
|
131671 |
51240870 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-116.62 |
7.85 |
-8.32 |
0.0 |
0 |
|
|
131672 |
51240918 |
1 |
N2O5C20H24 |
A2B5C20D24 |
-159.1 |
6.28 |
-9.14 |
-0.58 |
0 |
|
|
131673 |
51241022 |
1 |
SO2N5C20H21 |
AB2C5D20E21 |
-4.21 |
6.48 |
-8.98 |
-0.78 |
0 |
|
|
131674 |
51241023 |
1 |
SN3O4C15H21 |
AB3C4D15E21 |
-161.54 |
6.58 |
-8.98 |
-0.28 |
0 |
|
|
131675 |
51241477 |
1 |
FSO2N3H12C16 |
ABC2D3E12F16 |
-44.23 |
4.26 |
-9.17 |
-1.19 |
0 |
|
|
131676 |
51242362 |
1 |
ClFN2O2C16H16 |
ABC2D2E16F16 |
-93.53 |
5.24 |
-8.46 |
-0.32 |
0 |
|
|
131677 |
51242394 |
1 |
OF2N2C17H18 |
AB2C2D17E18 |
-90.06 |
5.15 |
-9.0 |
-0.38 |
0 |
|
|
131678 |
51242395 |
1 |
OF2N2C17H18 |
AB2C2D17E18 |
-86.52 |
2.73 |
-9.12 |
-0.41 |
0 |
|
|
131679 |
51243081 |
1 |
FO2N3C18H20 |
AB2C3D18E20 |
-96.63 |
4.15 |
-8.65 |
-0.41 |
0 |
|
|
131680 |
51243465 |
1 |
Cl2O2N3C15H21 |
A2B2C3D15E21 |
-103.05 |
3.73 |
-9.58 |
-0.85 |
0 |
|
|
131681 |
51243466 |
1 |
O3N4C22H28 |
A3B4C22D28 |
-103.65 |
4.75 |
-9.17 |
-0.66 |
0 |
|
|
131682 |
51243518 |
1 |
SO2N4C19H26 |
AB2C4D19E26 |
-66.23 |
7.07 |
-9.22 |
-0.82 |
0 |
|
|
131683 |
51243520 |
1 |
ON5C19H21 |
AB5C19D21 |
54.54 |
5.26 |
-8.83 |
-0.75 |
0 |
|
|
131684 |
51244047 |
1 |
ClO2N3C16H24 |
AB2C3D16E24 |
-103.01 |
5.02 |
-8.7 |
-0.02 |
0 |
|
|
131685 |
51244605 |
3 |
NOC7H9 |
ABC7D9 |
-87.14 |
6.73 |
-8.26 |
-0.31 |
0 |
|
|
131686 |
51244606 |
1 |
N3O3C20H25 |
A3B3C20D25 |
-82.24 |
6.43 |
-8.16 |
-0.46 |
0 |
|
|
131687 |
51244607 |
1 |
FO2N3C19H22 |
AB2C3D19E22 |
-91.61 |
7.28 |
-9.04 |
-0.41 |
0 |
|
|
131688 |
51245277 |
1 |
SO2N5C20H21 |
AB2C5D20E21 |
31.88 |
7.56 |
-9.41 |
-1.22 |
0 |
|
|
131689 |
51245297 |
1 |
ClOSN6C13H13 |
ABCD6E13F13 |
70.08 |
3.3 |
-9.6 |
-1.24 |
0 |
|
|
131690 |
51245320 |
1 |
SN9C16H21 |
AB9C16D21 |
126.52 |
8.51 |
-8.99 |
-0.65 |
0 |
|
|
131691 |
51245951 |
2 |
FNOC9H10 |
ABCD9E10 |
-133.38 |
5.92 |
-8.89 |
-0.36 |
0 |
|
|
131692 |
51245952 |
1 |
ClN2O2C19H23 |
AB2C2D19E23 |
-52.69 |
2.37 |
-8.54 |
-0.32 |
0 |
|
|
131693 |
51246102 |
1 |
OCl2N2H12C13 |
AB2C2D12E13 |
-16.1 |
4.53 |
-9.22 |
-0.76 |
0 |
|
|
131694 |
51246103 |
1 |
SCl2N2O3H14C16 |
AB2C2D3E14F16 |
-90.47 |
10.4 |
-8.83 |
-0.67 |
0 |
|
|
131695 |
51246212 |
1 |
ClFSN2O3H14C16 |
ABCD2E3F14G16 |
-126.21 |
9.71 |
-8.91 |
-0.45 |
0 |
|
|
131696 |
51247141 |
1 |
NSO4C19H23 |
ABC4D19E23 |
-137.19 |
5.29 |
-8.95 |
-0.66 |
0 |
|
|
131697 |
51247142 |
1 |
NSO4C19H23 |
ABC4D19E23 |
-136.96 |
4.92 |
-9.03 |
-0.75 |
0 |
|
|
131698 |
51247334 |
1 |
FNSO2H16C17 |
ABCD2E16F17 |
-84.01 |
2.67 |
-8.65 |
-0.48 |
0 |
|
|
131699 |
51247938 |
1 |
ClO2N4C17H17 |
AB2C4D17E17 |
-7.31 |
2.62 |
-9.24 |
-0.76 |
0 |
|
|
131700 |
51248083 |
1 |
O3N6C17H18 |
A3B6C17D18 |
41.05 |
6.48 |
-9.14 |
-1.09 |
0 |
|
|
131701 |
51248119 |
1 |
FO2N4H17C18 |
AB2C4D17E18 |
-21.95 |
5.08 |
-9.13 |
-0.81 |
0 |
|
|
131702 |
51248120 |
1 |
ON5C21H21 |
AB5C21D21 |
45.57 |
6.66 |
-8.52 |
-0.55 |
0 |
|
|
131703 |
51248121 |
1 |
OSN3C16H17 |
ABC3D16E17 |
25.21 |
4.92 |
-8.94 |
-0.62 |
0 |
|
|
131704 |
51248122 |
1 |
FO2N5H18C20 |
AB2C5D18E20 |
-14.02 |
4.06 |
-9.0 |
-0.92 |
0 |
|
|
131705 |
51248123 |
1 |
SN3O4C20H21 |
AB3C4D20E21 |
-104.33 |
6.36 |
-8.82 |
-0.45 |
0 |
|
|
131706 |
51248124 |
1 |
FSN2O2C19H19 |
ABC2D2E19F19 |
-73.94 |
4.09 |
-8.72 |
-0.6 |
0 |