List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
423472 |
135119561 |
1 |
N5O5C27H41 |
A5B5C27D41 |
-243.5 |
4.94 |
-9.32 |
0.06 |
0 |
|
|
423473 |
135119562 |
1 |
ON7C15H17 |
AB7C15D17 |
91.27 |
3.69 |
-9.39 |
-0.93 |
0 |
|
|
423474 |
135119563 |
1 |
O2N3C22H33 |
A2B3C22D33 |
-91.13 |
5.72 |
-8.49 |
0.37 |
0 |
|
|
423475 |
135119564 |
1 |
N3O3C15H23 |
A3B3C15D23 |
-66.29 |
3.67 |
-9.34 |
-0.32 |
0 |
|
|
423476 |
135119565 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-8.43 |
2.76 |
-8.7 |
-0.92 |
0 |
|
|
423478 |
135119568 |
1 |
O2N4C19H30 |
A2B4C19D30 |
-71.74 |
4.11 |
-9.04 |
0.34 |
0 |
|
|
423479 |
135119569 |
2 |
ON2C11H14 |
AB2C11D14 |
-37.07 |
5.94 |
-8.44 |
-0.13 |
0 |
|
|
423480 |
135119573 |
1 |
O5N8C30H36 |
A5B8C30D36 |
-89.66 |
14.85 |
-8.6 |
-0.74 |
0 |
|
|
423481 |
135119578 |
2 |
NSO2C7H11 |
ABC2D7E11 |
-154.1 |
7.0 |
-9.58 |
-0.83 |
0 |
|
|
423482 |
135119579 |
1 |
ON3C17H23 |
AB3C17D23 |
-8.07 |
4.04 |
-9.19 |
-0.13 |
0 |
|
|
423483 |
135119580 |
1 |
O2N5C13H19 |
A2B5C13D19 |
-39.4 |
6.13 |
-9.35 |
-0.04 |
0 |
|
|
423484 |
135119581 |
1 |
FN2O3C20H25 |
AB2C3D20E25 |
-146.42 |
6.67 |
-9.02 |
-0.1 |
0 |
|
|
423486 |
135119583 |
1 |
O6N7C39H47 |
A6B7C39D47 |
-97.74 |
5.07 |
-8.74 |
-1.47 |
0 |
|
|
423488 |
135119585 |
1 |
ClSN7O7C37H48 |
ABC7D7E37F48 |
-233.77 |
7.8 |
-8.96 |
-1.22 |
0 |
|
|
423489 |
135119586 |
1 |
O3N5C18H27 |
A3B5C18D27 |
-101.97 |
3.34 |
-9.27 |
-0.74 |
0 |
|
|
423491 |
135119588 |
1 |
FO2N4C20H23 |
AB2C4D20E23 |
-59.5 |
3.37 |
-9.06 |
-0.82 |
0 |
|
|
423492 |
135119593 |
1 |
N3O3C26H29 |
A3B3C26D29 |
-64.06 |
2.3 |
-8.97 |
-0.67 |
0 |
|
|
423493 |
135119598 |
1 |
SN3O4C14H21 |
AB3C4D14E21 |
-149.01 |
5.12 |
-9.92 |
-0.27 |
0 |
|
|
423494 |
135119599 |
1 |
SO2N4C20H22 |
AB2C4D20E22 |
-2.45 |
7.39 |
-9.63 |
-1.21 |
0 |
|
|
423495 |
135119601 |
1 |
O3N4C13H16 |
A3B4C13D16 |
-65.58 |
6.14 |
-9.42 |
-0.83 |
0 |
|
|
423496 |
135119602 |
2 |
NOC9H13 |
ABC9D13 |
-80.46 |
7.21 |
-8.67 |
0.42 |
0 |
|
|
423497 |
135119603 |
1 |
ClON5C22H24 |
ABC5D22E24 |
22.78 |
2.66 |
-8.56 |
-0.65 |
0 |
|
|
423498 |
135119609 |
1 |
N3C15H23 |
A3B15C23 |
5.88 |
4.47 |
-8.7 |
0.16 |
0 |
|
|
423499 |
135119610 |
1 |
O2N5C17H25 |
A2B5C17D25 |
-55.08 |
5.22 |
-9.24 |
-0.98 |
0 |
|
|
423500 |
135119611 |
1 |
N2O3C20H26 |
A2B3C20D26 |
-78.41 |
5.01 |
-9.18 |
0.12 |
0 |
|
|
423501 |
135119612 |
1 |
N2O2C15H24 |
A2B2C15D24 |
-99.74 |
3.55 |
-8.93 |
0.24 |
0 |
|
|
423502 |
135119620 |
1 |
ClN2O4C18H25 |
AB2C4D18E25 |
-154.47 |
5.84 |
-8.62 |
-0.31 |
0 |
|
|
423503 |
135119622 |
1 |
SN2O4C19H30 |
AB2C4D19E30 |
-161.19 |
8.13 |
-8.98 |
-0.52 |
0 |
|
|
423504 |
135119623 |
1 |
SN3O5C17H21 |
AB3C5D17E21 |
-162.8 |
4.53 |
-8.82 |
-1.27 |
0 |
|
|
423505 |
135119625 |
1 |
SO6N7C34H45 |
AB6C7D34E45 |
-197.03 |
5.64 |
-9.09 |
-1.32 |
0 |
|
|
423506 |
135119628 |
1 |
FSN2O2H17C19 |
ABC2D2E17F19 |
-53.29 |
7.53 |
-9.29 |
-1.22 |
0 |
|
|
423507 |
135119629 |
1 |
FO2N5C18H28 |
AB2C5D18E28 |
-91.42 |
1.88 |
-8.69 |
-0.23 |
0 |
|
|
423508 |
135119633 |
1 |
NSO3C17H25 |
ABC3D17E25 |
-110.54 |
1.54 |
-9.04 |
0.02 |
0 |
|
|
423509 |
135119634 |
1 |
O3N4C19H20 |
A3B4C19D20 |
-60.12 |
2.21 |
-9.41 |
-0.79 |
0 |
|
|
423510 |
135119638 |
1 |
ON5C22H29 |
AB5C22D29 |
12.89 |
6.75 |
-9.04 |
-0.86 |
0 |
|
|
423511 |
135119642 |
1 |
N3O4C18H23 |
A3B4C18D23 |
-86.02 |
1.34 |
-8.98 |
-1.24 |
0 |
|
|
423512 |
135119643 |
1 |
SF2N2O5C15H20 |
AB2C2D5E15F20 |
-279.66 |
7.47 |
-9.57 |
-0.32 |
0 |
|
|
423513 |
135119645 |
1 |
N3O5C15H23 |
A3B5C15D23 |
-214.94 |
5.38 |
-9.68 |
-0.45 |
0 |
|
|
423514 |
135119652 |
1 |
ON4C21H30 |
AB4C21D30 |
18.52 |
4.58 |
-8.52 |
-0.09 |
0 |
|
|
423515 |
135119653 |
1 |
SN3O4C14H21 |
AB3C4D14E21 |
-138.78 |
9.3 |
-9.69 |
-0.94 |
0 |
|
|
423516 |
135119658 |
1 |
ON5C19H35 |
AB5C19D35 |
-42.06 |
3.86 |
-8.49 |
0.71 |
0 |
|
|
423517 |
135119659 |
1 |
O2N3C18H29 |
A2B3C18D29 |
-62.63 |
1.27 |
-8.57 |
-0.06 |
0 |
|
|
423518 |
135119660 |
1 |
NF2O2C17H23 |
AB2C2D17E23 |
-190.19 |
5.66 |
-8.93 |
-0.12 |
0 |
|
|
423519 |
135119666 |
1 |
OSN5C17H21 |
ABC5D17E21 |
26.34 |
6.69 |
-9.02 |
-0.73 |
0 |
|
|
423520 |
135119667 |
1 |
FN3O3C22H30 |
AB3C3D22E30 |
-104.27 |
4.94 |
-9.05 |
-0.96 |
0 |
|
|
423521 |
135119668 |
1 |
SO2N4C18H22 |
AB2C4D18E22 |
-17.36 |
5.83 |
-8.76 |
-0.97 |
0 |
|
|
423522 |
135119669 |
1 |
S2N5O7C31H41 |
A2B5C7D31E41 |
-266.68 |
3.84 |
-8.83 |
-0.95 |
0 |
|
|
423523 |
135119670 |
1 |
FO3N5C21H26 |
AB3C5D21E26 |
-66.4 |
6.45 |
-9.15 |
-1.11 |
0 |
|
|
423524 |
135119671 |
1 |
NO4C22H27 |
AB4C22D27 |
-145.68 |
5.65 |
-8.68 |
-0.27 |
0 |
|
|
423525 |
135119672 |
2 |
NSO2C7H11 |
ABC2D7E11 |
-149.18 |
4.45 |
-8.98 |
-0.17 |
0 |
|
|
423526 |
135119673 |
1 |
S3N6O7C33H48 |
A3B6C7D33E48 |
-292.73 |
10.7 |
-8.59 |
-1.1 |
0 |
|
|
423527 |
135119674 |
1 |
FON5C18H22 |
ABC5D18E22 |
-22.19 |
4.27 |
-8.76 |
-0.2 |
0 |
|
|
423528 |
135119675 |
1 |
NO3C19H23 |
AB3C19D23 |
-108.17 |
3.7 |
-8.9 |
0.04 |
0 |
|
|
423529 |
135119676 |
1 |
O2N3C21H35 |
A2B3C21D35 |
-85.69 |
3.09 |
-8.6 |
0.34 |
0 |
|
|
423530 |
135119677 |
1 |
NO3C23H29 |
AB3C23D29 |
-90.13 |
5.17 |
-8.95 |
0.1 |
0 |
|
|
423531 |
135119678 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-131.29 |
5.88 |
-9.82 |
-0.2 |
0 |
|
|
423532 |
135119681 |
1 |
N3O3C19H19 |
A3B3C19D19 |
-62.39 |
3.48 |
-9.82 |
-0.89 |
0 |
|
|
423533 |
135119688 |
1 |
NO3C21H33 |
AB3C21D33 |
-196.58 |
5.93 |
-9.27 |
1.06 |
0 |
|
|
423534 |
135119689 |
1 |
NO4C22H27 |
AB4C22D27 |
-136.79 |
6.96 |
-9.1 |
-0.15 |
0 |
|
|
423535 |
135119691 |
1 |
OSN3C19H21 |
ABC3D19E21 |
26.1 |
3.78 |
-8.99 |
-0.81 |
0 |
|
|
423536 |
135119692 |
2 |
ON3C9H12 |
AB3C9D12 |
5.65 |
8.66 |
-9.08 |
-0.8 |
0 |
|
|
423537 |
135119693 |
1 |
OSN3C19H25 |
ABC3D19E25 |
4.85 |
3.1 |
-8.52 |
-0.29 |
0 |
|
|
423539 |
135119695 |
1 |
ON4C16H20 |
AB4C16D20 |
8.69 |
2.66 |
-9.07 |
-0.3 |
0 |
|
|
423540 |
135119696 |
1 |
ON5C14H17 |
AB5C14D17 |
16.28 |
2.5 |
-9.37 |
-0.26 |
0 |
|
|
423541 |
135119699 |
1 |
ClN3O3C17H20 |
AB3C3D17E20 |
-88.71 |
5.16 |
-9.32 |
-0.49 |
0 |
|
|
423542 |
135119701 |
1 |
N2O4C23H28 |
A2B4C23D28 |
-130.75 |
5.66 |
-8.78 |
-0.16 |
0 |
|
|
423543 |
135119702 |
1 |
N5C18H27 |
A5B18C27 |
65.2 |
2.96 |
-8.59 |
-0.78 |
0 |
|
|
423544 |
135119703 |
1 |
ON6C16H24 |
AB6C16D24 |
3.33 |
4.3 |
-8.18 |
0.2 |
0 |
|
|
423545 |
135119705 |
1 |
N3O4C18H21 |
A3B4C18D21 |
-101.42 |
3.15 |
-9.01 |
-0.72 |
0 |
|
|
423546 |
135119706 |
1 |
SN3O3C17H21 |
AB3C3D17E21 |
-75.78 |
8.13 |
-8.65 |
-0.11 |
0 |
|
|
423547 |
135119710 |
1 |
N2O3C22H26 |
A2B3C22D26 |
-67.51 |
4.75 |
-8.93 |
0.09 |
0 |
|
|
423548 |
135119712 |
1 |
OF3N3C20H22 |
AB3C3D20E22 |
-178.72 |
2.72 |
-9.17 |
-1.12 |
0 |
|
|
423549 |
135119715 |
1 |
O6N7C33H49 |
A6B7C33D49 |
-240.4 |
6.36 |
-8.91 |
0.06 |
0 |
|
|
423550 |
135119717 |
1 |
O2N3C22H27 |
A2B3C22D27 |
-18.82 |
3.88 |
-8.9 |
-0.09 |
0 |
|
|
423552 |
135119719 |
1 |
O2N3C19H23 |
A2B3C19D23 |
-46.06 |
1.19 |
-9.22 |
-0.28 |
0 |
|
|
423553 |
135119720 |
1 |
SO2N5C22H25 |
AB2C5D22E25 |
2.9 |
5.63 |
-9.11 |
-0.67 |
0 |
|
|
423554 |
135119723 |
2 |
NO3C9H11 |
AB3C9D11 |
-209.44 |
6.34 |
-9.23 |
-0.58 |
0 |
|
|
423555 |
135119732 |
1 |
ClNSO3C16H22 |
ABCD3E16F22 |
-141.38 |
4.4 |
-9.37 |
-0.49 |
0 |
|
|
423556 |
135119733 |
1 |
N2O3C23H30 |
A2B3C23D30 |
-120.85 |
2.35 |
-8.84 |
-0.54 |
0 |
|
|
423557 |
135119734 |
1 |
N3O4C22H29 |
A3B4C22D29 |
-126.7 |
6.33 |
-8.76 |
-0.46 |
0 |
|
|
423558 |
135119737 |
1 |
O3N4C19H22 |
A3B4C19D22 |
13.37 |
2.7 |
-8.89 |
-1.52 |
0 |
|
|
423559 |
135119741 |
1 |
O7N8C45H54 |
A7B8C45D54 |
-215.55 |
9.51 |
-8.35 |
-1.03 |
0 |
|
|
423560 |
135119742 |
1 |
ON4C16H22 |
AB4C16D22 |
24.96 |
3.58 |
-8.69 |
-0.09 |
0 |
|
|
423561 |
135119743 |
1 |
N2O3C23H26 |
A2B3C23D26 |
-87.5 |
6.26 |
-9.08 |
-0.39 |
0 |
|
|
423562 |
135119744 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-76.71 |
3.2 |
-9.74 |
-0.3 |
0 |
|
|
423563 |
135119745 |
1 |
ClFO4N5C27H31 |
ABC4D5E27F31 |
-135.3 |
6.04 |
-8.66 |
-0.42 |
0 |
|
|
423564 |
135119746 |
1 |
O3N4C22H32 |
A3B4C22D32 |
-51.19 |
7.53 |
-8.88 |
-0.17 |
0 |
|
|
423565 |
135119747 |
1 |
O3N5C16H27 |
A3B5C16D27 |
-71.72 |
4.98 |
-8.78 |
-0.31 |
0 |
|
|
423566 |
135119749 |
1 |
O4N5C21H27 |
A4B5C21D27 |
-102.24 |
2.89 |
-9.34 |
-0.3 |
0 |
|
|
423567 |
135119751 |
1 |
N3O3C19H25 |
A3B3C19D25 |
-63.85 |
3.76 |
-8.21 |
-0.85 |
0 |
|
|
423568 |
135119752 |
1 |
O7N8C36H48 |
A7B8C36D48 |
-287.91 |
3.42 |
-8.65 |
-0.42 |
0 |
|
|
423569 |
135119755 |
1 |
SN4O4C14H22 |
AB4C4D14E22 |
-109.19 |
6.97 |
-9.58 |
0.04 |
0 |
|
|
423570 |
135119757 |
1 |
NO5C15H19 |
AB5C15D19 |
-190.65 |
4.08 |
-8.66 |
-0.1 |
0 |
|
|
423571 |
135119758 |
2 |
ON2C9H10 |
AB2C9D10 |
-40.12 |
5.54 |
-9.46 |
-0.78 |
0 |
|
|
423573 |
135119760 |
1 |
FN4O4C18H23 |
AB4C4D18E23 |
-118.51 |
4.88 |
-8.86 |
-1.01 |
0 |
|
|
423574 |
135119761 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-35.01 |
3.32 |
-9.2 |
-0.07 |
0 |
|
|
423575 |
135119762 |
1 |
N6O6C33H46 |
A6B6C33D46 |
-248.33 |
7.03 |
-8.85 |
-0.4 |
0 |
|
|
423576 |
135119763 |
1 |
ClO2N3C19H26 |
AB2C3D19E26 |
-96.92 |
7.78 |
-7.97 |
-0.05 |
0 |
|
|
423577 |
135119764 |
1 |
NO6C22H31 |
AB6C22D31 |
-247.73 |
3.39 |
-8.37 |
-0.43 |
0 |
|
|
423578 |
135119765 |
1 |
FNSO5C13H16 |
ABCD5E13F16 |
-248.85 |
9.0 |
-10.15 |
-1.21 |
0 |