List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
364867 |
127316339 |
1 |
SO2N3C21H33 |
AB2C3D21E33 |
-104.54 |
8.06 |
-8.85 |
-0.64 |
0 |
|
|
364868 |
127316340 |
1 |
SO2N3C20H31 |
AB2C3D20E31 |
-103.81 |
4.95 |
-9.21 |
-0.54 |
0 |
|
|
364869 |
127316341 |
1 |
OSN4C21H30 |
ABC4D21E30 |
-9.92 |
5.07 |
-9.04 |
-0.33 |
0 |
|
|
364870 |
127316342 |
1 |
OS2N5C18H21 |
AB2C5D18E21 |
53.51 |
5.06 |
-8.97 |
-0.68 |
0 |
|
|
364871 |
127316343 |
1 |
SO2N3C19H29 |
AB2C3D19E29 |
-93.66 |
8.07 |
-8.98 |
-0.75 |
0 |
|
|
364872 |
127316344 |
1 |
OS2N5C17H25 |
AB2C5D17E25 |
5.78 |
2.96 |
-8.52 |
-0.41 |
0 |
|
|
364873 |
127316345 |
1 |
SO2N3C17H25 |
AB2C3D17E25 |
-83.29 |
6.61 |
-9.02 |
-0.52 |
0 |
|
|
364874 |
127316346 |
1 |
SO2N3C22H29 |
AB2C3D22E29 |
-77.85 |
9.14 |
-8.79 |
-0.77 |
0 |
|
|
364875 |
127316347 |
1 |
SN2O3C20H24 |
AB2C3D20E24 |
-79.28 |
6.31 |
-8.72 |
-0.38 |
0 |
|
|
364876 |
127316348 |
1 |
SO2N3C22H27 |
AB2C3D22E27 |
-38.53 |
6.01 |
-8.72 |
-0.26 |
0 |
|
|
364877 |
127316349 |
1 |
O2S2N3C19H29 |
A2B2C3D19E29 |
-93.63 |
1.76 |
-8.58 |
-0.26 |
0 |
|
|
364878 |
127316350 |
1 |
SN2O2C20H28 |
AB2C2D20E28 |
-88.52 |
2.09 |
-9.24 |
-0.49 |
0 |
|
|
364879 |
127316351 |
1 |
SO2N3C20H29 |
AB2C3D20E29 |
-88.18 |
7.55 |
-9.2 |
-0.78 |
0 |
|
|
364880 |
127316352 |
1 |
SO2N5C19H21 |
AB2C5D19E21 |
5.96 |
4.44 |
-9.25 |
-1.23 |
0 |
|
|
364881 |
127316353 |
1 |
SO2N3C20H25 |
AB2C3D20E25 |
-63.99 |
5.53 |
-8.8 |
0.0 |
0 |
|
|
364882 |
127316367 |
2 |
ON2C7H10 |
AB2C7D10 |
-45.8 |
2.46 |
-8.81 |
-0.89 |
0 |
|
|
364883 |
127316382 |
1 |
ON5C21H31 |
AB5C21D31 |
3.33 |
4.15 |
-8.74 |
-0.62 |
0 |
|
|
364884 |
127316383 |
1 |
ON5C17H21 |
AB5C17D21 |
47.93 |
4.86 |
-8.87 |
-1.1 |
0 |
|
|
364885 |
127316393 |
1 |
ON3C16H25 |
AB3C16D25 |
-25.21 |
2.43 |
-8.85 |
0.7 |
0 |
|
|
364886 |
127316394 |
1 |
ON5C23H29 |
AB5C23D29 |
40.93 |
3.97 |
-8.53 |
-0.02 |
0 |
|
|
364887 |
127316395 |
1 |
SN3O3C16H29 |
AB3C3D16E29 |
-140.39 |
2.35 |
-8.62 |
0.39 |
0 |
|
|
364888 |
127316396 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-108.8 |
5.66 |
-8.79 |
0.35 |
0 |
|
|
364889 |
127316397 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-83.06 |
7.5 |
-8.99 |
0.46 |
0 |
|
|
364890 |
127316478 |
1 |
O2N3C18H23 |
A2B3C18D23 |
-64.95 |
4.22 |
-8.75 |
-0.52 |
0 |
|
|
364891 |
127316479 |
1 |
SN4O4C16H26 |
AB4C4D16E26 |
-120.43 |
5.07 |
-8.56 |
-0.55 |
0 |
|
|
364892 |
127316480 |
1 |
SN2O3C13H22 |
AB2C3D13E22 |
-128.69 |
5.5 |
-8.97 |
0.49 |
0 |
|
|
364893 |
127316481 |
1 |
O2N3C18H25 |
A2B3C18D25 |
-64.31 |
1.68 |
-8.62 |
0.0 |
0 |
|
|
364894 |
127316482 |
1 |
O2N3C22H35 |
A2B3C22D35 |
-117.21 |
4.25 |
-8.68 |
0.95 |
0 |
|
|
364895 |
127316483 |
1 |
O2F3N3C18H22 |
A2B3C3D18E22 |
-216.44 |
1.14 |
-8.77 |
-1.28 |
0 |
|
|
364896 |
127316484 |
1 |
OSN5C17H21 |
ABC5D17E21 |
42.42 |
3.84 |
-8.72 |
-1.6 |
0 |
|
|
364897 |
127316485 |
1 |
O2N4C19H28 |
A2B4C19D28 |
-62.05 |
2.77 |
-8.52 |
-0.91 |
0 |
|
|
364898 |
127316486 |
2 |
ON2C10H13 |
AB2C10D13 |
-3.32 |
3.66 |
-8.59 |
-0.7 |
0 |
|
|
364899 |
127316487 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-108.24 |
2.54 |
-8.78 |
0.2 |
0 |
|
|
364900 |
127316488 |
1 |
OSN6C13H22 |
ABC6D13E22 |
35.12 |
2.49 |
-8.73 |
-0.68 |
0 |
|
|
364901 |
127316489 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-83.99 |
5.78 |
-8.92 |
0.52 |
0 |
|
|
364902 |
127316490 |
1 |
ON5C21H29 |
AB5C21D29 |
24.42 |
5.68 |
-8.67 |
-0.47 |
0 |
|
|
364903 |
127316491 |
1 |
SO3N5C15H25 |
AB3C5D15E25 |
-88.29 |
11.93 |
-8.59 |
-0.09 |
0 |
|
|
364904 |
127316492 |
1 |
SN2O3C16H28 |
AB2C3D16E28 |
-132.94 |
8.04 |
-8.5 |
0.68 |
0 |
|
|
364905 |
127316493 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-91.33 |
5.38 |
-8.93 |
0.55 |
0 |
|
|
364906 |
127316494 |
1 |
OSN5C14H23 |
ABC5D14E23 |
6.94 |
4.19 |
-8.56 |
-0.4 |
0 |
|
|
364907 |
127316495 |
1 |
O2N3C22H31 |
A2B3C22D31 |
-76.99 |
4.26 |
-8.66 |
-0.11 |
0 |
|
|
364908 |
127316496 |
1 |
N3O3C16H27 |
A3B3C16D27 |
-126.69 |
5.51 |
-8.95 |
0.45 |
0 |
|
|
364909 |
127316497 |
1 |
SN3O3C20H29 |
AB3C3D20E29 |
-99.98 |
1.66 |
-8.72 |
-0.73 |
0 |
|
|
364910 |
127316498 |
1 |
ON5C19H29 |
AB5C19D29 |
1.9 |
3.2 |
-8.62 |
0.6 |
0 |
|
|
364911 |
127316499 |
1 |
SO3N4C18H24 |
AB3C4D18E24 |
-55.45 |
0.95 |
-8.74 |
-1.51 |
0 |
|
|
364912 |
127316500 |
1 |
SN3O4C19H27 |
AB3C4D19E27 |
-129.27 |
5.4 |
-8.53 |
-0.9 |
0 |
|
|
364913 |
127316501 |
1 |
FO2N4C22H23 |
AB2C4D22E23 |
-12.72 |
5.94 |
-9.08 |
-1.42 |
0 |
|
|
364914 |
127316560 |
1 |
ClON5C20H26 |
ABC5D20E26 |
26.45 |
6.94 |
-8.5 |
-0.86 |
0 |
|
|
364915 |
127316561 |
1 |
ON5C23H35 |
AB5C23D35 |
-14.93 |
3.71 |
-8.75 |
-0.46 |
0 |
|
|
364916 |
127316562 |
1 |
S2N3O3C18H27 |
A2B3C3D18E27 |
-86.59 |
7.97 |
-8.29 |
-1.09 |
0 |
|
|
364917 |
127316563 |
1 |
ON3C13H21 |
AB3C13D21 |
-19.53 |
3.98 |
-8.78 |
0.48 |
0 |
|
|
364918 |
127316564 |
1 |
N3O3C20H27 |
A3B3C20D27 |
-77.21 |
2.58 |
-8.75 |
-0.14 |
0 |
|
|
364919 |
127316565 |
1 |
O2N5C20H29 |
A2B5C20D29 |
-29.73 |
8.09 |
-8.47 |
-1.07 |
0 |
|
|
364920 |
127316566 |
1 |
O2N5C21H31 |
A2B5C21D31 |
-33.44 |
3.56 |
-8.41 |
-0.19 |
0 |
|
|
364921 |
127316567 |
2 |
ON2C9H13 |
AB2C9D13 |
-65.8 |
1.92 |
-8.8 |
0.19 |
0 |
|
|
364922 |
127316568 |
1 |
OSN5C15H25 |
ABC5D15E25 |
-0.21 |
3.35 |
-8.7 |
-0.08 |
0 |
|
|
364923 |
127316569 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-89.86 |
3.84 |
-8.82 |
0.77 |
0 |
|
|
364924 |
127316570 |
1 |
SO2N4C19H26 |
AB2C4D19E26 |
-57.3 |
3.78 |
-8.8 |
-1.03 |
0 |
|
|
364925 |
127316571 |
1 |
O2N4C21H32 |
A2B4C21D32 |
-75.67 |
2.86 |
-8.57 |
-0.13 |
0 |
|
|
364926 |
127316572 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-102.11 |
6.54 |
-8.77 |
-0.14 |
0 |
|
|
364927 |
127316573 |
1 |
O2N3C20H29 |
A2B3C20D29 |
-83.73 |
8.03 |
-8.64 |
0.02 |
0 |
|
|
364928 |
127316574 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-19.51 |
6.54 |
-8.94 |
-0.81 |
0 |
|
|
364929 |
127316575 |
1 |
O3N4C14H22 |
A3B4C14D22 |
-111.21 |
5.82 |
-8.73 |
-0.32 |
0 |
|
|
364930 |
127316576 |
3 |
NOC7H9 |
ABC7D9 |
-92.93 |
2.6 |
-8.54 |
-1.38 |
0 |
|
|
364931 |
127316577 |
2 |
NOC7H12 |
ABC7D12 |
-91.5 |
2.6 |
-8.71 |
0.85 |
0 |
|
|
364932 |
127316578 |
1 |
SN3O3C20H29 |
AB3C3D20E29 |
-99.52 |
6.76 |
-8.89 |
-0.89 |
0 |
|
|
364933 |
127316579 |
1 |
Cl2O2N3C17H21 |
A2B2C3D17E21 |
-69.27 |
2.42 |
-8.77 |
-1.22 |
0 |
|
|
364934 |
127316580 |
1 |
O3N4C17H28 |
A3B4C17D28 |
-135.58 |
5.82 |
-8.68 |
-0.16 |
0 |
|
|
364935 |
127316583 |
1 |
ON5C20H27 |
AB5C20D27 |
25.05 |
4.71 |
-8.67 |
-0.5 |
0 |
|
|
364936 |
127316584 |
1 |
O2N4C15H24 |
A2B4C15D24 |
-42.32 |
2.38 |
-8.59 |
0.39 |
0 |
|
|
364937 |
127316585 |
1 |
BrON4C16H19 |
ABC4D16E19 |
30.35 |
4.86 |
-8.67 |
-0.88 |
0 |
|
|
364938 |
127316586 |
1 |
OS2N5C17H23 |
AB2C5D17E23 |
44.12 |
3.08 |
-8.65 |
-0.73 |
0 |
|
|
364939 |
127316587 |
1 |
SN3O3C14H25 |
AB3C3D14E25 |
-125.87 |
3.88 |
-8.6 |
0.35 |
0 |
|
|
364940 |
127316588 |
1 |
SO2N3C19H27 |
AB2C3D19E27 |
-70.98 |
5.07 |
-8.53 |
-0.54 |
0 |
|
|
364941 |
127316589 |
1 |
ON5C20H29 |
AB5C20D29 |
7.21 |
4.63 |
-8.76 |
-0.64 |
0 |