List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
369492 |
127334214 |
1 |
O2N3C16H17 |
A2B3C16D17 |
-17.3 |
6.2 |
-9.2 |
-1.05 |
0 |
|
|
369493 |
127334227 |
1 |
O2N3C17H19 |
A2B3C17D19 |
-23.88 |
6.47 |
-9.11 |
-0.89 |
0 |
|
|
369494 |
127334228 |
1 |
N2O2C25H36 |
A2B2C25D36 |
-123.67 |
5.17 |
-9.58 |
1.13 |
0 |
|
|
369495 |
127334231 |
1 |
O2N3C17H27 |
A2B3C17D27 |
-101.67 |
6.85 |
-9.19 |
0.95 |
0 |
|
|
369496 |
127334232 |
1 |
ClNOC12H14 |
ABCD12E14 |
-48.04 |
5.76 |
-8.96 |
0.0 |
0 |
|
|
369497 |
127334239 |
1 |
O3N4C11H18 |
A3B4C11D18 |
-127.01 |
4.19 |
-8.86 |
-0.33 |
0 |
|
|
369498 |
127334240 |
1 |
ON5C19H25 |
AB5C19D25 |
23.38 |
4.95 |
-8.61 |
-0.58 |
0 |
|
|
369499 |
127334241 |
1 |
ClON2C12H15 |
ABC2D12E15 |
-30.34 |
4.54 |
-9.4 |
-0.86 |
0 |
|
|
369500 |
127334242 |
1 |
ClON2C13H17 |
ABC2D13E17 |
-36.86 |
4.62 |
-9.36 |
-0.85 |
0 |
|
|
369501 |
127334243 |
1 |
ClON2C12H15 |
ABC2D12E15 |
-31.37 |
3.45 |
-9.5 |
-0.88 |
0 |
|
|
369502 |
127334244 |
1 |
ON5C18H23 |
AB5C18D23 |
31.26 |
6.06 |
-8.67 |
-0.63 |
0 |
|
|
369503 |
127334245 |
1 |
ClON3C12H16 |
ABC3D12E16 |
-11.95 |
4.22 |
-8.96 |
-0.88 |
0 |
|
|
369504 |
127334246 |
1 |
N3O4C21H31 |
A3B4C21D31 |
-163.83 |
1.58 |
-8.74 |
0.09 |
0 |
|
|
369505 |
127334247 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-54.93 |
3.25 |
-8.6 |
-0.64 |
0 |
|
|
369506 |
127334248 |
2 |
N2O2C10H17 |
A2B2C10D17 |
-201.88 |
3.6 |
-9.13 |
0.67 |
0 |
|
|
369507 |
127334249 |
1 |
SO2N4C20H32 |
AB2C4D20E32 |
-83.02 |
3.23 |
-8.8 |
-0.08 |
0 |
|
|
369508 |
127334250 |
1 |
FSN2O3C18H23 |
ABC2D3E18F23 |
-133.81 |
4.31 |
-9.14 |
-0.39 |
0 |
|
|
369509 |
127334251 |
1 |
O3N5C20H33 |
A3B5C20D33 |
-100.91 |
3.83 |
-8.71 |
0.3 |
0 |
|
|
369510 |
127334263 |
1 |
O3N4C16H24 |
A3B4C16D24 |
-89.32 |
4.45 |
-9.15 |
0.21 |
0 |
|
|
369511 |
127334264 |
3 |
NOC5H7 |
ABC5D7 |
-148.81 |
3.35 |
-9.93 |
-0.36 |
0 |
|
|
369512 |
127334268 |
1 |
O2N5C18H21 |
A2B5C18D21 |
5.22 |
3.18 |
-9.52 |
-1.2 |
0 |
|
|
369513 |
127334269 |
1 |
O2N5C18H25 |
A2B5C18D25 |
-48.53 |
8.49 |
-8.57 |
-0.46 |
0 |
|
|
369514 |
127334270 |
1 |
SO3N5C18H23 |
AB3C5D18E23 |
-57.42 |
5.52 |
-8.28 |
-0.37 |
0 |
|
|
369515 |
127334271 |
1 |
FSN3O4C18H24 |
ABC3D4E18F24 |
-161.11 |
3.88 |
-9.32 |
-0.36 |
0 |
|
|
369516 |
127334286 |
1 |
O3N4C13H20 |
A3B4C13D20 |
-132.69 |
5.69 |
-8.98 |
-0.06 |
0 |
|
|
369517 |
127334287 |
1 |
ON5C20H25 |
AB5C20D25 |
21.14 |
6.09 |
-8.46 |
-0.57 |
0 |
|
|
369518 |
127334288 |
1 |
O2N4C19H34 |
A2B4C19D34 |
-123.18 |
6.45 |
-8.86 |
0.74 |
0 |
|
|
369519 |
127334289 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-19.81 |
4.63 |
-8.61 |
-0.57 |
0 |
|
|
369520 |
127334290 |
1 |
ON4C19H24 |
AB4C19D24 |
14.75 |
2.94 |
-9.34 |
-0.91 |
0 |
|
|
369521 |
127334291 |
1 |
ON2C16H24 |
AB2C16D24 |
-38.98 |
5.18 |
-9.49 |
0.81 |
0 |
|
|
369522 |
127334292 |
1 |
ON5C18H25 |
AB5C18D25 |
16.86 |
5.58 |
-8.48 |
-0.28 |
0 |
|
|
369523 |
127334293 |
1 |
OSN4C14H16 |
ABC4D14E16 |
39.57 |
2.04 |
-8.72 |
-1.09 |
0 |
|
|
369524 |
127334294 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-59.32 |
4.57 |
-9.11 |
0.3 |
0 |
|
|
369525 |
127334295 |
1 |
OSN4C13H14 |
ABC4D13E14 |
42.13 |
2.59 |
-8.75 |
-1.11 |
0 |
|
|
369526 |
127334296 |
2 |
ON3C9H15 |
AB3C9D15 |
-73.11 |
7.69 |
-9.36 |
0.19 |
0 |
|
|
369527 |
127334297 |
2 |
ON2C10H12 |
AB2C10D12 |
-23.39 |
5.07 |
-8.61 |
-0.65 |
0 |
|
|
369528 |
127334298 |
1 |
O2N3C23H27 |
A2B3C23D27 |
-39.9 |
4.43 |
-8.82 |
0.09 |
0 |
|
|
369529 |
127334299 |
1 |
FN3O4C20H22 |
AB3C4D20E22 |
-175.73 |
4.61 |
-9.24 |
-0.3 |
0 |
|
|
369530 |
127334300 |
4 |
NOC4H5 |
ABC4D5 |
-134.12 |
4.27 |
-9.45 |
-0.31 |
0 |
|
|
369531 |
127334312 |
1 |
O2N4C19H22 |
A2B4C19D22 |
-11.31 |
4.91 |
-8.64 |
-0.66 |
0 |
|
|
369532 |
127334313 |
1 |
ON5C19H27 |
AB5C19D27 |
14.27 |
1.22 |
-8.59 |
-1.07 |
0 |
|
|
369533 |
127334314 |
1 |
O2N6C21H28 |
A2B6C21D28 |
-32.65 |
6.4 |
-9.7 |
-1.06 |
0 |
|
|
369534 |
127334315 |
1 |
SO2N5C19H31 |
AB2C5D19E31 |
-73.99 |
2.66 |
-8.77 |
-0.45 |
0 |
|
|
369535 |
127334557 |
2 |
ON2C10H11 |
AB2C10D11 |
-36.83 |
5.87 |
-7.94 |
-0.91 |
0 |
|
|
369536 |
127334558 |
1 |
ON5C17H21 |
AB5C17D21 |
28.8 |
3.59 |
-8.06 |
-0.16 |
0 |
|
|
369537 |
127334559 |
2 |
ON2C9H12 |
AB2C9D12 |
-56.59 |
2.38 |
-8.24 |
-0.21 |
0 |
|
|
369538 |
127334560 |
1 |
O2N3C18H25 |
A2B3C18D25 |
-61.8 |
1.4 |
-8.17 |
-0.21 |
0 |
|
|
369539 |
127334561 |
1 |
SO2N4C20H28 |
AB2C4D20E28 |
-55.72 |
5.02 |
-8.46 |
-0.45 |
0 |
|
|
369540 |
127334562 |
1 |
SO2N4C19H26 |
AB2C4D19E26 |
-50.01 |
4.12 |
-8.41 |
-0.41 |
0 |
|
|
369541 |
127334563 |
1 |
ON5C19H25 |
AB5C19D25 |
24.27 |
2.16 |
-8.29 |
-0.4 |
0 |
|
|
369542 |
127334564 |
1 |
ON6C20H22 |
AB6C20D22 |
51.48 |
4.58 |
-7.87 |
-0.98 |
0 |
|
|
369543 |
127334565 |
1 |
O2N6C21H26 |
A2B6C21D26 |
-4.66 |
1.66 |
-8.23 |
-0.25 |
0 |
|
|
369544 |
127334566 |
1 |
SO3N4C18H26 |
AB3C4D18E26 |
-96.16 |
3.1 |
-8.21 |
-0.24 |
0 |
|
|
369545 |
127334567 |
1 |
O2N4C17H22 |
A2B4C17D22 |
-51.94 |
3.36 |
-8.12 |
-0.16 |
0 |
|
|
369546 |
127334568 |
1 |
O3N5C19H23 |
A3B5C19D23 |
-85.96 |
4.35 |
-8.2 |
-0.35 |
0 |
|
|
369547 |
127334569 |
1 |
ON5C18H27 |
AB5C18D27 |
-0.28 |
1.66 |
-8.12 |
-0.19 |
0 |
|
|
369548 |
127334570 |
1 |
SO2N4C18H24 |
AB2C4D18E24 |
-44.03 |
3.07 |
-8.2 |
-0.35 |
0 |
|
|
369549 |
127334571 |
1 |
SO2N3C18H19 |
AB2C3D18E19 |
-10.51 |
1.34 |
-8.2 |
-0.89 |
0 |
|
|
369550 |
127334572 |
1 |
ON5C19H25 |
AB5C19D25 |
19.69 |
4.38 |
-7.96 |
-0.1 |
0 |
|
|
369551 |
127334573 |
1 |
O3N4C20H20 |
A3B4C20D20 |
-67.03 |
6.3 |
-8.0 |
-1.21 |
0 |
|
|
369552 |
127334574 |
1 |
O3N4C18H24 |
A3B4C18D24 |
-90.42 |
2.48 |
-8.06 |
-0.12 |
0 |
|
|
369553 |
127334575 |
1 |
ON5C16H19 |
AB5C16D19 |
39.85 |
3.03 |
-8.06 |
-0.21 |
0 |
|
|
369554 |
127334576 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-54.84 |
2.72 |
-8.26 |
-0.29 |
0 |
|
|
369555 |
127334577 |
1 |
ON4C16H18 |
AB4C16D18 |
40.01 |
3.62 |
-8.4 |
-0.4 |
0 |
|
|
369556 |
127334611 |
2 |
ON2C11H14 |
AB2C11D14 |
-34.74 |
3.7 |
-8.78 |
-0.31 |
0 |
|
|
369557 |
127334612 |
1 |
O3N6C14H18 |
A3B6C14D18 |
-75.52 |
5.35 |
-8.94 |
-0.44 |
0 |
|
|
369558 |
127334613 |
1 |
O2N4C17H26 |
A2B4C17D26 |
-66.76 |
2.51 |
-8.8 |
-0.31 |
0 |
|
|
369559 |
127334614 |
1 |
ON7C20H29 |
AB7C20D29 |
21.28 |
4.27 |
-8.9 |
-0.44 |
0 |
|
|
369560 |
127334615 |
1 |
OSN5C19H21 |
ABC5D19E21 |
34.64 |
7.43 |
-8.67 |
-1.22 |
0 |
|
|
369561 |
127334616 |
1 |
ON5C22H25 |
AB5C22D25 |
23.69 |
5.4 |
-8.41 |
-0.62 |
0 |
|
|
369562 |
127334617 |
1 |
ON4C22H22 |
AB4C22D22 |
41.58 |
3.31 |
-8.71 |
-0.63 |
0 |
|
|
369563 |
127334618 |
1 |
O2N7C20H27 |
A2B7C20D27 |
-8.22 |
4.94 |
-8.88 |
-0.38 |
0 |
|
|
369564 |
127334619 |
1 |
ON4C18H28 |
AB4C18D28 |
-34.69 |
6.67 |
-8.87 |
-0.5 |
0 |
|
|
369565 |
127334620 |
1 |
O2N5C15H21 |
A2B5C15D21 |
-49.36 |
4.54 |
-8.94 |
-0.38 |
0 |
|
|
369566 |
127334621 |
1 |
ON4C22H32 |
AB4C22D32 |
-45.27 |
1.32 |
-8.84 |
-0.4 |
0 |
|
|
369567 |
127334622 |
1 |
O2N5C22H27 |
A2B5C22D27 |
-23.45 |
5.55 |
-8.68 |
-0.28 |
0 |
|
|
369568 |
127334623 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-39.25 |
2.2 |
-8.59 |
-0.63 |
0 |
|
|
369569 |
127334624 |
1 |
OSN6C17H22 |
ABC6D17E22 |
36.76 |
4.45 |
-8.73 |
-0.32 |
0 |
|
|
369570 |
127334625 |
1 |
ON6C17H28 |
AB6C17D28 |
-1.58 |
1.25 |
-8.51 |
-0.15 |
0 |
|
|
369571 |
127334626 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-68.02 |
2.8 |
-8.74 |
-0.24 |
0 |
|
|
369572 |
127334759 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-121.26 |
4.32 |
-8.76 |
-0.04 |
0 |
|
|
369573 |
127334760 |
1 |
O2N4C19H22 |
A2B4C19D22 |
-45.9 |
7.22 |
-9.28 |
-0.24 |
0 |
|
|
369574 |
127334761 |
1 |
O2N3C23H23 |
A2B3C23D23 |
-10.9 |
7.25 |
-9.0 |
-0.42 |
0 |
|
|
369575 |
127334762 |
1 |
O2N4C21H26 |
A2B4C21D26 |
-58.34 |
4.0 |
-8.62 |
0.19 |
0 |
|
|
369576 |
127334763 |
1 |
SO2N3C22H23 |
AB2C3D22E23 |
-12.92 |
7.6 |
-8.84 |
-0.62 |
0 |
|
|
369577 |
127334764 |
1 |
O3N4C22H28 |
A3B4C22D28 |
-99.16 |
2.41 |
-8.6 |
-0.18 |
0 |
|
|
369578 |
127334765 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-60.17 |
7.38 |
-9.15 |
-0.31 |
0 |
|
|
369579 |
127334766 |
1 |
O3N5C20H21 |
A3B5C20D21 |
-73.69 |
5.94 |
-9.05 |
-0.68 |
0 |
|
|
369580 |
127334767 |
2 |
ON2C11H12 |
AB2C11D12 |
9.23 |
4.2 |
-8.68 |
-0.54 |
0 |
|
|
369581 |
127334768 |
1 |
SO3N4C19H24 |
AB3C4D19E24 |
-82.75 |
3.95 |
-8.94 |
-0.12 |
0 |
|
|
369582 |
127334769 |
1 |
SN3O3C20H25 |
AB3C3D20E25 |
-96.76 |
11.06 |
-9.28 |
-0.58 |
0 |
|
|
369583 |
127334770 |
1 |
ON5C20H21 |
AB5C20D21 |
36.41 |
7.13 |
-9.09 |
-0.75 |
0 |
|
|
369584 |
127334771 |
1 |
ON4C20H26 |
AB4C20D26 |
1.22 |
7.76 |
-8.45 |
-0.35 |
0 |
|
|
369585 |
127334772 |
1 |
ClO2N4C18H19 |
AB2C4D18E19 |
-51.63 |
4.37 |
-8.91 |
-0.54 |
0 |
|
|
369586 |
127334773 |
1 |
ClO2N4C21H21 |
AB2C4D21E21 |
6.38 |
4.35 |
-8.84 |
-0.52 |
0 |
|
|
369587 |
127334833 |
1 |
O2N7C18H21 |
A2B7C18D21 |
85.17 |
5.5 |
-8.81 |
-1.29 |
0 |
|
|
369588 |
127334834 |
1 |
SO2N5C18H23 |
AB2C5D18E23 |
53.61 |
6.42 |
-8.88 |
-0.82 |
0 |
|
|
369589 |
127334835 |
1 |
O3N5C20H31 |
A3B5C20D31 |
-68.19 |
3.66 |
-8.91 |
-0.26 |
0 |
|
|
369590 |
127334836 |
1 |
O2N6C17H22 |
A2B6C17D22 |
38.28 |
3.84 |
-9.14 |
-0.95 |
0 |
|
|
369591 |
127334837 |
1 |
O2N4C23H34 |
A2B4C23D34 |
-37.06 |
1.01 |
-8.97 |
-0.31 |
0 |