List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
126536 |
50967402 |
1 |
F2N2H14C17 |
A2B2C14D17 |
-21.46 |
6.08 |
-8.59 |
-0.63 |
0 |
|
|
126537 |
50967495 |
1 |
N2O7C18H20 |
A2B7C18D20 |
-264.25 |
2.94 |
-9.81 |
-0.55 |
0 |
|
|
126538 |
50967567 |
1 |
SO2N6C18H24 |
AB2C6D18E24 |
-20.51 |
4.26 |
-9.52 |
-0.72 |
0 |
|
|
126539 |
50967585 |
1 |
N2O2C15H22 |
A2B2C15D22 |
-66.34 |
3.3 |
-9.21 |
-0.07 |
0 |
|
|
126540 |
50967586 |
1 |
ON5C17H17 |
AB5C17D17 |
67.57 |
3.86 |
-8.78 |
-0.46 |
0 |
|
|
126541 |
50967587 |
1 |
ON6C19H24 |
AB6C19D24 |
37.77 |
9.8 |
-8.95 |
-0.16 |
0 |
|
|
126542 |
50967606 |
1 |
O3N4C20H20 |
A3B4C20D20 |
-10.94 |
2.2 |
-9.13 |
-1.01 |
0 |
|
|
126543 |
50967607 |
2 |
NO2H7C8 |
AB2C7D8 |
-102.96 |
1.19 |
-9.34 |
-0.96 |
0 |
|
|
126544 |
50967608 |
1 |
N2O3C15H20 |
A2B3C15D20 |
-48.04 |
4.24 |
-8.68 |
0.06 |
0 |
|
|
126545 |
50967609 |
1 |
O2N4C17H20 |
A2B4C17D20 |
-15.31 |
6.18 |
-8.73 |
-0.54 |
0 |
|
|
126546 |
50967610 |
1 |
SO3N4C14H22 |
AB3C4D14E22 |
-85.43 |
6.45 |
-9.07 |
-0.54 |
0 |
|
|
126547 |
50967611 |
1 |
SN3O5C17H19 |
AB3C5D17E19 |
-127.5 |
1.84 |
-8.98 |
-0.6 |
0 |
|
|
126548 |
50967612 |
1 |
ON3H19C20 |
AB3C19D20 |
40.94 |
6.24 |
-8.99 |
-0.71 |
0 |
|
|
126549 |
50967637 |
1 |
ON5C16H23 |
AB5C16D23 |
20.52 |
3.33 |
-9.02 |
-0.66 |
0 |
|
|
126550 |
50967638 |
1 |
SO2N5C17H19 |
AB2C5D17E19 |
-15.57 |
7.23 |
-8.94 |
-0.78 |
0 |
|
|
126551 |
50967639 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-12.14 |
7.26 |
-9.21 |
0.01 |
0 |
|
|
126552 |
50967640 |
2 |
ON2C11H13 |
AB2C11D13 |
12.25 |
5.47 |
-9.18 |
0.19 |
0 |
|
|
126553 |
50967641 |
1 |
N2O3C15H28 |
A2B3C15D28 |
-161.57 |
6.56 |
-8.7 |
1.04 |
0 |
|
|
126554 |
50967665 |
1 |
ClN4C18H19 |
AB4C18D19 |
59.26 |
5.43 |
-8.79 |
-0.57 |
0 |
|
|
126555 |
50967688 |
1 |
ON5C18H19 |
AB5C18D19 |
87.61 |
4.18 |
-9.14 |
-0.59 |
0 |
|
|
126556 |
50967765 |
1 |
O2N3C19H29 |
A2B3C19D29 |
-71.58 |
7.81 |
-8.17 |
0.28 |
0 |
|
|
126557 |
50968008 |
1 |
SO3N5C17H17 |
AB3C5D17E17 |
-29.58 |
3.85 |
-9.25 |
-0.95 |
0 |
|
|
126558 |
50968013 |
1 |
ON5C20H23 |
AB5C20D23 |
20.18 |
3.3 |
-8.85 |
-0.29 |
0 |
|
|
126559 |
50968081 |
1 |
SO2N3C21H25 |
AB2C3D21E25 |
3.22 |
3.97 |
-8.65 |
-0.46 |
0 |
|
|
126560 |
50968113 |
1 |
SN3O3C19H19 |
AB3C3D19E19 |
-49.69 |
4.15 |
-9.22 |
-0.88 |
0 |
|
|
126561 |
50968114 |
1 |
ClON4C17H19 |
ABC4D17E19 |
61.23 |
4.71 |
-8.87 |
-0.72 |
0 |
|
|
126562 |
50968115 |
1 |
SO2N3C19H25 |
AB2C3D19E25 |
-55.9 |
4.77 |
-8.38 |
-0.51 |
0 |
|
|
126563 |
50968130 |
1 |
N6H18C19 |
A6B18C19 |
119.9 |
3.71 |
-8.68 |
-0.65 |
0 |
|
|
126564 |
50968131 |
1 |
OF3N4C19H23 |
AB3C4D19E23 |
-170.84 |
2.22 |
-8.75 |
-1.21 |
0 |
|
|
126565 |
50968132 |
1 |
O3N4C16H18 |
A3B4C16D18 |
-1.33 |
3.55 |
-9.42 |
-1.01 |
0 |
|
|
126566 |
50968145 |
1 |
S2O3N4C14H16 |
A2B3C4D14E16 |
-28.62 |
7.13 |
-9.58 |
-0.88 |
0 |
|
|
126567 |
50968181 |
1 |
OSN2C15H26 |
ABC2D15E26 |
-31.91 |
2.91 |
-8.76 |
-0.04 |
0 |
|
|
126568 |
50968246 |
3 |
NOC7H7 |
ABC7D7 |
-30.45 |
7.73 |
-8.86 |
-0.43 |
0 |
|
|
126569 |
50968281 |
1 |
O3N5C19H31 |
A3B5C19D31 |
-107.71 |
4.64 |
-9.13 |
0.49 |
0 |
|
|
126570 |
50968305 |
1 |
ON3C18H27 |
AB3C18D27 |
-66.82 |
1.64 |
-8.69 |
0.34 |
0 |
|
|
126571 |
50968490 |
1 |
O2N5C17H17 |
A2B5C17D17 |
29.82 |
6.13 |
-9.43 |
-1.22 |
0 |
|
|
126572 |
50968491 |
1 |
F2N2O3C21H22 |
A2B2C3D21E22 |
-150.78 |
6.37 |
-8.67 |
-0.87 |
0 |
|
|
126573 |
50968492 |
1 |
FON2C16H21 |
ABC2D16E21 |
-73.23 |
2.81 |
-8.76 |
-0.25 |
0 |
|
|
126574 |
50968493 |
1 |
N7H17C18 |
A7B17C18 |
170.77 |
9.73 |
-9.91 |
-0.4 |
0 |
|
|
126575 |
50968494 |
1 |
ClOSN5C15H16 |
ABCD5E15F16 |
38.35 |
11.22 |
-8.85 |
-0.71 |
0 |
|
|
126576 |
50968495 |
1 |
O3N4H18C21 |
A3B4C18D21 |
-26.31 |
1.4 |
-8.67 |
-0.72 |
0 |
|
|
126577 |
50968517 |
1 |
O2N4C15H20 |
A2B4C15D20 |
-30.1 |
3.75 |
-9.13 |
0.12 |
0 |
|
|
126578 |
50968518 |
1 |
SN2O3C17H24 |
AB2C3D17E24 |
-115.2 |
7.13 |
-9.03 |
-0.37 |
0 |
|
|
126579 |
50968527 |
1 |
N3O3C20H27 |
A3B3C20D27 |
-85.24 |
4.77 |
-8.99 |
-0.15 |
0 |
|
|
126580 |
50968546 |
1 |
ClO2N6C17H23 |
AB2C6D17E23 |
-18.39 |
2.87 |
-8.43 |
0.0 |
0 |
|
|
126581 |
50968560 |
2 |
ON2C7H7 |
AB2C7D7 |
26.37 |
3.79 |
-9.38 |
-0.36 |
0 |
|
|
126582 |
50968763 |
1 |
O2N3C18H19 |
A2B3C18D19 |
-13.32 |
2.86 |
-8.28 |
-1.04 |
0 |
|
|
126583 |
50968885 |
1 |
ON3C21H33 |
AB3C21D33 |
-42.96 |
3.77 |
-8.68 |
0.46 |
0 |
|
|
126584 |
50968886 |
1 |
OF3N5C16H22 |
AB3C5D16E22 |
-175.58 |
7.36 |
-9.01 |
-1.37 |
0 |
|
|
126585 |
50968971 |
1 |
ClO3N4H15C18 |
AB3C4D15E18 |
-45.16 |
3.12 |
-9.22 |
-0.75 |
0 |
|
|
126586 |
50968972 |
1 |
O3N4C16H24 |
A3B4C16D24 |
-110.46 |
2.39 |
-9.21 |
0.03 |
0 |
|
|
126587 |
50968973 |
1 |
ON4H18C19 |
AB4C18D19 |
65.86 |
6.53 |
-9.33 |
-1.36 |
0 |
|
|
126588 |
50968990 |
1 |
O2N4H16C17 |
A2B4C16D17 |
32.21 |
7.49 |
-9.18 |
-1.5 |
0 |
|
|
126589 |
50969005 |
1 |
O2N5C19H29 |
A2B5C19D29 |
-48.26 |
4.79 |
-9.71 |
-0.01 |
0 |
|
|
126590 |
50969030 |
1 |
O3N4C19H22 |
A3B4C19D22 |
-73.76 |
6.43 |
-8.9 |
-0.33 |
0 |
|
|
126591 |
50969031 |
2 |
N2H6C7 |
A2B6C7 |
94.44 |
2.12 |
-9.04 |
-0.7 |
0 |
|
|
126592 |
50969032 |
1 |
N2O2C19H20 |
A2B2C19D20 |
-15.57 |
6.95 |
-8.94 |
-0.83 |
0 |
|
|
126593 |
50969238 |
1 |
FN2O3C17H21 |
AB2C3D17E21 |
-157.27 |
2.71 |
-8.92 |
-0.01 |
0 |
|
|
126594 |
50969239 |
1 |
OSN6H16C18 |
ABC6D16E18 |
74.91 |
3.3 |
-8.92 |
-1.18 |
0 |
|
|
126595 |
50969274 |
1 |
ON5C19H23 |
AB5C19D23 |
16.15 |
2.39 |
-9.12 |
-1.11 |
0 |
|
|
126596 |
50969275 |
1 |
N4O4C17H22 |
A4B4C17D22 |
-138.35 |
2.61 |
-9.21 |
-0.08 |
0 |
|
|
126597 |
50969276 |
1 |
SN2O3C15H22 |
AB2C3D15E22 |
-122.01 |
4.37 |
-8.96 |
0.04 |
0 |
|
|
126598 |
50969277 |
1 |
N6C17H26 |
A6B17C26 |
52.44 |
2.86 |
-8.26 |
0.4 |
0 |
|
|
126599 |
50969405 |
1 |
N3O3C13H21 |
A3B3C13D21 |
-105.86 |
2.53 |
-8.84 |
0.02 |
0 |
|
|
126600 |
50969524 |
1 |
N4C15H20 |
A4B15C20 |
30.8 |
2.71 |
-8.93 |
-0.28 |
0 |
|
|
126601 |
50969629 |
1 |
ON7C20H25 |
AB7C20D25 |
62.22 |
10.75 |
-8.86 |
-0.71 |
0 |
|
|
126602 |
50969640 |
1 |
FO2N6C16H19 |
AB2C6D16E19 |
-44.9 |
2.62 |
-9.01 |
-0.8 |
0 |
|
|
126603 |
50969641 |
1 |
ON6C20H22 |
AB6C20D22 |
75.08 |
3.17 |
-8.83 |
-0.87 |
0 |
|
|
126604 |
50969642 |
1 |
N3O3H19C21 |
A3B3C19D21 |
-32.43 |
5.13 |
-9.22 |
-0.68 |
0 |
|
|
126605 |
50969789 |
1 |
OSN5C15H21 |
ABC5D15E21 |
16.17 |
7.16 |
-8.98 |
-0.39 |
0 |
|
|
126606 |
50969790 |
1 |
OSN6C18H20 |
ABC6D18E20 |
70.74 |
6.23 |
-8.46 |
-0.45 |
0 |
|
|
126607 |
50969791 |
1 |
ON7C18H23 |
AB7C18D23 |
51.19 |
1.68 |
-8.86 |
-0.45 |
0 |
|
|
126608 |
50969898 |
1 |
SN6C16H20 |
AB6C16D20 |
81.51 |
2.35 |
-8.72 |
-0.85 |
0 |
|
|
126609 |
50970082 |
1 |
O3N5C20H21 |
A3B5C20D21 |
-42.13 |
4.86 |
-9.12 |
-0.41 |
0 |
|
|
126610 |
50970083 |
1 |
SO3N4C14H16 |
AB3C4D14E16 |
-49.75 |
1.7 |
-8.54 |
-1.26 |
0 |
|
|
126611 |
50970181 |
1 |
O3N5C17H25 |
A3B5C17D25 |
-104.43 |
5.76 |
-8.68 |
0.16 |
0 |
|
|
126612 |
50970186 |
1 |
N2S2O4C15H22 |
A2B2C4D15E22 |
-162.24 |
2.63 |
-8.75 |
-0.42 |
0 |
|
|
126613 |
50970264 |
1 |
ClN2O4C16H21 |
AB2C4D16E21 |
-159.02 |
2.53 |
-8.89 |
-0.33 |
0 |
|
|
126614 |
50970265 |
1 |
OSN5C12H13 |
ABC5D12E13 |
51.92 |
4.11 |
-9.02 |
-0.75 |
0 |
|
|
126615 |
50970266 |
1 |
ClN3O3C18H20 |
AB3C3D18E20 |
-105.75 |
0.92 |
-9.04 |
-0.63 |
0 |
|
|
126616 |
50970267 |
1 |
OSN3C20H21 |
ABC3D20E21 |
25.05 |
3.99 |
-9.38 |
-0.53 |
0 |
|
|
126617 |
50970268 |
1 |
O2N6C17H28 |
A2B6C17D28 |
-50.72 |
0.54 |
-8.61 |
0.36 |
0 |
|
|
126618 |
50970269 |
1 |
ON5H17C22 |
AB5C17D22 |
116.58 |
5.16 |
-8.79 |
-1.0 |
0 |
|
|
126619 |
50970270 |
2 |
ON2H11C12 |
AB2C11D12 |
11.45 |
4.34 |
-8.89 |
-1.14 |
0 |
|
|
126620 |
50970304 |
2 |
ON2C8H10 |
AB2C8D10 |
-42.69 |
4.62 |
-9.11 |
-0.32 |
0 |
|
|
126621 |
50970329 |
1 |
N3O3C13H21 |
A3B3C13D21 |
-136.64 |
2.7 |
-9.76 |
0.24 |
0 |
|
|
126622 |
50970362 |
1 |
O3N4C16H24 |
A3B4C16D24 |
-118.31 |
3.76 |
-9.27 |
0.12 |
0 |
|
|
126623 |
50970403 |
1 |
F2O2N6H16C17 |
A2B2C6D16E17 |
-47.68 |
7.26 |
-8.96 |
-1.39 |
0 |
|
|
126624 |
50970484 |
1 |
O2N3H15C17 |
A2B3C15D17 |
-4.45 |
5.82 |
-8.51 |
-0.85 |
0 |
|
|
126625 |
50970638 |
1 |
ON4C20H32 |
AB4C20D32 |
-31.58 |
1.97 |
-7.8 |
0.38 |
0 |
|
|
126626 |
50970643 |
1 |
N7C20H23 |
A7B20C23 |
120.22 |
5.67 |
-8.81 |
-0.32 |
0 |
|
|
126627 |
50970644 |
1 |
ON3C24H25 |
AB3C24D25 |
66.14 |
7.25 |
-8.7 |
-0.62 |
0 |
|
|
126628 |
50970645 |
1 |
ON5H13C15 |
AB5C13D15 |
104.54 |
2.67 |
-9.2 |
-0.53 |
0 |
|
|
126629 |
50970764 |
1 |
N7C12H13 |
A7B12C13 |
143.02 |
10.73 |
-9.27 |
-0.85 |
0 |
|
|
126630 |
50970883 |
1 |
N3O4C21H23 |
A3B4C21D23 |
-75.92 |
9.97 |
-8.98 |
-0.78 |
0 |
|
|
126631 |
50970902 |
1 |
ON5C19H31 |
AB5C19D31 |
-25.68 |
6.49 |
-8.7 |
-0.14 |
0 |
|
|
126632 |
50970913 |
1 |
N3O4C21H23 |
A3B4C21D23 |
-72.5 |
8.34 |
-8.73 |
-0.55 |
0 |
|
|
126633 |
50970917 |
1 |
ClFON3H11C12 |
ABCD3E11F12 |
-22.09 |
2.85 |
-9.09 |
-0.32 |
0 |
|
|
126634 |
50970965 |
1 |
SO2N3C17H19 |
AB2C3D17E19 |
-11.67 |
6.36 |
-8.78 |
-0.74 |
0 |
|
|
126635 |
50971059 |
1 |
ClSN3O3C14H16 |
ABC3D3E14F16 |
-76.25 |
6.58 |
-9.47 |
-1.22 |
0 |