List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
367492 |
127324824 |
2 |
ON2C10H14 |
AB2C10D14 |
-83.23 |
4.07 |
-9.31 |
0.23 |
0 |
|
|
367493 |
127324825 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-174.36 |
6.72 |
-9.47 |
0.5 |
0 |
|
|
367494 |
127324826 |
2 |
ON2C10H15 |
AB2C10D15 |
-83.87 |
1.67 |
-9.11 |
-0.74 |
0 |
|
|
367495 |
127324827 |
1 |
SN4O4C15H20 |
AB4C4D15E20 |
-135.35 |
7.33 |
-9.32 |
-1.03 |
0 |
|
|
367496 |
127324828 |
1 |
SO3N4C11H18 |
AB3C4D11E18 |
-103.36 |
4.77 |
-9.21 |
0.07 |
0 |
|
|
367497 |
127324829 |
1 |
S2N3O3C11H17 |
A2B3C3D11E17 |
-115.02 |
6.41 |
-9.03 |
-0.55 |
0 |
|
|
367498 |
127324830 |
1 |
SN3O3C11H15 |
AB3C3D11E15 |
-106.96 |
5.18 |
-9.4 |
-0.36 |
0 |
|
|
367499 |
127324831 |
1 |
SN3O3C11H15 |
AB3C3D11E15 |
-106.55 |
5.06 |
-9.73 |
-0.37 |
0 |
|
|
367500 |
127324832 |
1 |
S2N3O3C15H17 |
A2B3C3D15E17 |
-73.13 |
6.8 |
-9.21 |
-0.95 |
0 |
|
|
367501 |
127324833 |
1 |
SO3N4C15H22 |
AB3C4D15E22 |
-112.05 |
4.79 |
-7.91 |
0.16 |
0 |
|
|
367502 |
127324834 |
1 |
SN2O3C16H18 |
AB2C3D16E18 |
-97.65 |
5.81 |
-8.66 |
-0.66 |
0 |
|
|
367503 |
127324835 |
1 |
S2O3N4C8H12 |
A2B3C4D8E12 |
-73.32 |
5.8 |
-10.1 |
-1.29 |
0 |
|
|
367504 |
127324836 |
1 |
SN3O4C10H15 |
AB3C4D10E15 |
-126.86 |
8.18 |
-9.81 |
-0.34 |
0 |
|
|
367505 |
127324837 |
1 |
SN2O5C15H22 |
AB2C5D15E22 |
-194.96 |
2.64 |
-8.45 |
0.01 |
0 |
|
|
367506 |
127324838 |
1 |
SN4O4C15H22 |
AB4C4D15E22 |
-144.74 |
7.2 |
-8.45 |
-0.33 |
0 |
|
|
367507 |
127324839 |
1 |
O2N6C17H28 |
A2B6C17D28 |
-47.65 |
3.45 |
-8.67 |
0.51 |
0 |
|
|
367508 |
127324840 |
1 |
SO2N5C17H27 |
AB2C5D17E27 |
-58.09 |
3.33 |
-8.96 |
-0.44 |
0 |
|
|
367509 |
127324841 |
1 |
SO2N6C14H22 |
AB2C6D14E22 |
-28.87 |
4.06 |
-8.86 |
-1.31 |
0 |
|
|
367510 |
127324842 |
1 |
O3N5C16H25 |
A3B5C16D25 |
-69.88 |
5.13 |
-9.04 |
-0.2 |
0 |
|
|
367511 |
127324848 |
1 |
ON4C11H14 |
AB4C11D14 |
77.44 |
3.26 |
-9.65 |
-0.63 |
0 |
|
|
367512 |
127324849 |
1 |
O2N5C21H33 |
A2B5C21D33 |
-77.4 |
3.54 |
-8.59 |
-0.26 |
0 |
|
|
367513 |
127324850 |
1 |
ON5C21H35 |
AB5C21D35 |
-26.93 |
5.14 |
-8.53 |
-0.22 |
0 |
|
|
367514 |
127324851 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-71.44 |
8.69 |
-8.53 |
-1.05 |
0 |
|
|
367515 |
127324866 |
1 |
O2N6C21H28 |
A2B6C21D28 |
-25.45 |
2.67 |
-8.64 |
0.03 |
0 |
|
|
367516 |
127324867 |
1 |
OF3N4C20H25 |
AB3C4D20E25 |
-170.5 |
3.93 |
-8.77 |
-0.89 |
0 |
|
|
367517 |
127324868 |
1 |
ClO2N3C20H26 |
AB2C3D20E26 |
-86.94 |
4.31 |
-8.97 |
-0.28 |
0 |
|
|
367518 |
127324869 |
1 |
O3N6C20H24 |
A3B6C20D24 |
-62.47 |
5.28 |
-8.74 |
0.01 |
0 |
|
|
367519 |
127324870 |
1 |
O4N5C19H21 |
A4B5C19D21 |
-102.12 |
3.01 |
-8.64 |
-0.54 |
0 |
|
|
367520 |
127324871 |
1 |
NOC15H25 |
ABC15D25 |
-74.42 |
4.0 |
-9.26 |
1.21 |
0 |
|
|
367521 |
127324872 |
1 |
ON2C15H28 |
AB2C15D28 |
-83.51 |
3.59 |
-8.78 |
1.12 |
0 |
|
|
367522 |
127324873 |
1 |
O2N4C21H30 |
A2B4C21D30 |
-72.44 |
3.31 |
-9.2 |
0.62 |
0 |
|
|
367523 |
127324874 |
1 |
O4N5C18H27 |
A4B5C18D27 |
-144.35 |
2.36 |
-9.47 |
0.37 |
0 |
|
|
367524 |
127324884 |
1 |
ON4C12H20 |
AB4C12D20 |
-20.07 |
3.98 |
-9.97 |
0.13 |
0 |
|
|
367525 |
127324885 |
1 |
FSN2O4C17H23 |
ABC2D4E17F23 |
-198.33 |
3.82 |
-9.14 |
-0.34 |
0 |
|
|
367526 |
127324886 |
1 |
SN3O3C20H25 |
AB3C3D20E25 |
-113.11 |
2.84 |
-8.7 |
-0.09 |
0 |
|
|
367527 |
127324887 |
1 |
SO2N3C21H21 |
AB2C3D21E21 |
45.01 |
4.96 |
-9.03 |
-1.26 |
0 |
|
|
367528 |
127324888 |
1 |
SN3O3C20H25 |
AB3C3D20E25 |
-113.46 |
5.96 |
-8.74 |
-0.21 |
0 |
|
|
367529 |
127324889 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
21.81 |
3.35 |
-8.96 |
-1.23 |
0 |
|
|
367530 |
127324890 |
1 |
SO2N3C19H19 |
AB2C3D19E19 |
21.68 |
5.15 |
-9.03 |
-1.21 |
0 |
|
|
367531 |
127324891 |
1 |
S2N3O4C11H17 |
A2B3C4D11E17 |
-128.79 |
9.36 |
-9.18 |
-0.59 |
0 |
|
|
367532 |
127324892 |
1 |
ON4C15H18 |
AB4C15D18 |
65.48 |
6.82 |
-9.59 |
-1.14 |
0 |
|
|
367533 |
127324901 |
1 |
SN2O3C17H30 |
AB2C3D17E30 |
-160.35 |
9.22 |
-8.86 |
0.54 |
0 |
|
|
367534 |
127324902 |
1 |
O2N3C21H31 |
A2B3C21D31 |
-101.81 |
6.43 |
-8.41 |
-0.66 |
0 |
|
|
367535 |
127324903 |
1 |
N3O3C21H29 |
A3B3C21D29 |
-115.8 |
3.52 |
-8.62 |
-0.7 |
0 |
|
|
367536 |
127324904 |
1 |
N3O3C20H27 |
A3B3C20D27 |
-111.12 |
5.39 |
-8.65 |
-0.7 |
0 |
|
|
367537 |
127324905 |
1 |
ON2C14H26 |
AB2C14D26 |
-75.29 |
3.87 |
-8.52 |
1.06 |
0 |
|
|
367538 |
127324906 |
2 |
ON2C10H13 |
AB2C10D13 |
2.02 |
2.86 |
-8.77 |
-1.28 |
0 |
|
|
367539 |
127324907 |
1 |
ON5C22H35 |
AB5C22D35 |
-23.21 |
5.68 |
-8.55 |
0.59 |
0 |
|
|
367540 |
127324908 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-114.3 |
5.9 |
-8.51 |
-0.36 |
0 |
|
|
367541 |
127324909 |
1 |
OSN5C18H31 |
ABC5D18E31 |
-25.64 |
3.98 |
-8.68 |
-0.17 |
0 |
|
|
367542 |
127324910 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-25.34 |
5.01 |
-8.57 |
-1.38 |
0 |
|
|
367543 |
127324911 |
1 |
FO2N4C22H27 |
AB2C4D22E27 |
-72.29 |
4.87 |
-8.74 |
-1.29 |
0 |
|
|
367544 |
127324912 |
1 |
SN2O3C16H28 |
AB2C3D16E28 |
-154.27 |
5.54 |
-8.83 |
0.54 |
0 |
|
|
367545 |
127324913 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-14.78 |
4.72 |
-8.77 |
-1.18 |
0 |
|
|
367546 |
127324914 |
1 |
SO2N3C20H31 |
AB2C3D20E31 |
-90.68 |
3.06 |
-8.49 |
-0.27 |
0 |
|
|
367547 |
127324915 |
1 |
O2N3C22H31 |
A2B3C22D31 |
-63.37 |
6.25 |
-8.44 |
-0.34 |
0 |
|
|
367548 |
127324916 |
1 |
O3N4C20H32 |
A3B4C20D32 |
-130.25 |
6.38 |
-8.59 |
-0.18 |
0 |
|
|
367549 |
127324917 |
1 |
ON6C14H24 |
AB6C14D24 |
19.45 |
5.74 |
-8.83 |
-0.67 |
0 |
|
|
367550 |
127324918 |
2 |
ON3C9H15 |
AB3C9D15 |
-38.14 |
7.4 |
-8.42 |
0.02 |
0 |
|
|
367551 |
127324919 |
1 |
OSN5C20H27 |
ABC5D20E27 |
16.45 |
2.68 |
-8.53 |
-1.57 |
0 |
|
|
367552 |
127324920 |
2 |
ON2C8H13 |
AB2C8D13 |
-63.29 |
2.37 |
-8.51 |
-0.41 |
0 |
|
|
367553 |
127324921 |
1 |
O2N5C20H29 |
A2B5C20D29 |
-48.92 |
5.29 |
-8.4 |
-0.98 |
0 |
|
|
367554 |
127324922 |
2 |
ON2C10H13 |
AB2C10D13 |
-4.55 |
4.54 |
-8.63 |
-1.13 |
0 |
|
|
367555 |
127324923 |
1 |
SN3O3C16H29 |
AB3C3D16E29 |
-144.87 |
2.39 |
-8.47 |
0.04 |
0 |
|
|
367556 |
127324924 |
1 |
SN3O3C17H31 |
AB3C3D17E31 |
-151.24 |
3.82 |
-8.48 |
0.36 |
0 |
|
|
367557 |
127324936 |
1 |
SO2N3C21H29 |
AB2C3D21E29 |
-84.65 |
5.64 |
-8.68 |
-0.82 |
0 |
|
|
367558 |
127324937 |
1 |
OSN5C19H25 |
ABC5D19E25 |
28.76 |
3.98 |
-8.61 |
-1.65 |
0 |
|
|
367559 |
127324938 |
1 |
O3N4C17H28 |
A3B4C17D28 |
-79.54 |
3.06 |
-8.53 |
-0.73 |
0 |
|
|
367560 |
127324939 |
1 |
ON6C19H26 |
AB6C19D26 |
34.55 |
6.33 |
-8.8 |
-1.26 |
0 |
|
|
367561 |
127324940 |
1 |
ON6C18H26 |
AB6C18D26 |
26.94 |
3.66 |
-8.36 |
-1.35 |
0 |
|
|
367562 |
127324941 |
1 |
O3N5C21H29 |
A3B5C21D29 |
-107.44 |
4.15 |
-8.9 |
-1.38 |
0 |
|
|
367563 |
127324942 |
2 |
NOC8H14 |
ABC8D14 |
-110.19 |
3.26 |
-8.67 |
0.76 |
0 |
|
|
367564 |
127324993 |
1 |
NSO4C18H25 |
ABC4D18E25 |
-155.08 |
4.44 |
-8.64 |
0.01 |
0 |
|
|
367565 |
127324994 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-41.04 |
6.97 |
-9.09 |
-0.49 |
0 |
|
|
367566 |
127324995 |
1 |
O2N5C21H27 |
A2B5C21D27 |
-43.46 |
5.97 |
-9.14 |
-0.54 |
0 |
|
|
367567 |
127325001 |
1 |
O2N5C15H19 |
A2B5C15D19 |
-4.0 |
4.08 |
-9.9 |
-0.79 |
0 |
|
|
367568 |
127325002 |
1 |
OSN5C15H19 |
ABC5D15E19 |
40.93 |
3.34 |
-8.76 |
-0.93 |
0 |
|
|
367569 |
127325027 |
1 |
N3O3C17H29 |
A3B3C17D29 |
-149.86 |
5.98 |
-8.78 |
0.81 |
0 |
|
|
367570 |
127325028 |
1 |
NO2C17H27 |
AB2C17D27 |
-124.17 |
3.6 |
-9.15 |
1.15 |
0 |
|
|
367571 |
127325029 |
1 |
SN2O3C20H22 |
AB2C3D20E22 |
-90.7 |
9.97 |
-8.92 |
-0.57 |
0 |
|
|
367572 |
127325030 |
1 |
SN3O4C20H21 |
AB3C4D20E21 |
-120.81 |
12.14 |
-7.99 |
-0.62 |
0 |
|
|
367573 |
127325031 |
1 |
SN3O4C20H21 |
AB3C4D20E21 |
-121.43 |
13.43 |
-8.45 |
-0.63 |
0 |
|
|
367574 |
127325036 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-71.75 |
5.16 |
-8.99 |
0.19 |
0 |
|
|
367575 |
127325037 |
1 |
O2N5C18H29 |
A2B5C18D29 |
-61.3 |
4.63 |
-8.87 |
0.38 |
0 |
|
|
367576 |
127325038 |
1 |
NOC13H25 |
ABC13D25 |
-95.14 |
3.82 |
-9.08 |
1.31 |
0 |
|
|
367577 |
127325039 |
1 |
NO2C13H23 |
AB2C13D23 |
-118.62 |
3.06 |
-9.28 |
0.93 |
0 |
|
|
367578 |
127325040 |
1 |
N2O2C13H24 |
A2B2C13D24 |
-124.85 |
6.21 |
-9.17 |
0.82 |
0 |
|
|
367579 |
127325041 |
1 |
N2O2C15H26 |
A2B2C15D26 |
-124.94 |
6.2 |
-9.2 |
0.81 |
0 |
|
|
367580 |
127325042 |
1 |
ON3C13H21 |
AB3C13D21 |
-39.18 |
4.59 |
-8.96 |
0.35 |
0 |
|
|
367581 |
127325043 |
1 |
O3N5C17H27 |
A3B5C17D27 |
-97.25 |
3.85 |
-9.1 |
0.59 |
0 |
|
|
367582 |
127325044 |
1 |
NOC13H25 |
ABC13D25 |
-95.65 |
3.78 |
-9.12 |
1.27 |
0 |
|
|
367583 |
127325045 |
1 |
O2N3C11H19 |
A2B3C11D19 |
-60.57 |
4.44 |
-9.03 |
0.14 |
0 |
|
|
367584 |
127325046 |
1 |
ON4C12H20 |
AB4C12D20 |
-16.13 |
5.94 |
-8.6 |
0.29 |
0 |
|
|
367585 |
127325047 |
1 |
ON2C15H28 |
AB2C15D28 |
-79.2 |
4.18 |
-8.7 |
1.15 |
0 |
|
|
367586 |
127325069 |
2 |
ON3C10H13 |
AB3C10D13 |
-0.59 |
8.31 |
-9.26 |
-1.0 |
0 |
|
|
367587 |
127325076 |
1 |
O2N3C24H33 |
A2B3C24D33 |
-90.09 |
8.46 |
-9.23 |
0.06 |
0 |
|
|
367588 |
127325077 |
1 |
N3O3C21H29 |
A3B3C21D29 |
-103.82 |
5.52 |
-9.03 |
0.08 |
0 |
|
|
367589 |
127325078 |
1 |
SO3N4C18H28 |
AB3C4D18E28 |
-122.79 |
4.93 |
-8.79 |
-0.32 |
0 |
|
|
367590 |
127325079 |
1 |
S2N4O4C15H20 |
A2B4C4D15E20 |
-105.84 |
8.24 |
-9.24 |
-1.0 |
0 |
|
|
367591 |
127325080 |
1 |
O3N4C19H28 |
A3B4C19D28 |
-105.8 |
3.14 |
-9.29 |
-0.22 |
0 |