List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
73352 |
48417497 |
2 |
ON2H8C9 |
AB2C8D9 |
28.07 |
4.68 |
-8.61 |
-0.92 |
0 |
|
|
73353 |
48417501 |
1 |
BrFON4H6C11 |
ABCD4E6F11 |
23.06 |
3.42 |
-9.57 |
-1.62 |
0 |
|
|
73354 |
48417502 |
1 |
O2N7H11C14 |
A2B7C11D14 |
91.76 |
4.41 |
-9.56 |
-1.22 |
0 |
|
|
73355 |
48417503 |
1 |
O3N5H15C16 |
A3B5C15D16 |
7.32 |
5.86 |
-8.98 |
-1.07 |
0 |
|
|
73356 |
48417512 |
1 |
SO2N5H13C17 |
AB2C5D13E17 |
52.74 |
6.2 |
-9.33 |
-1.26 |
0 |
|
|
73357 |
48417513 |
1 |
O2F3N5H14C17 |
A2B3C5D14E17 |
-147.77 |
3.03 |
-9.67 |
-1.23 |
0 |
|
|
73358 |
48417515 |
1 |
BrO2N4H13C14 |
AB2C4D13E14 |
13.7 |
6.35 |
-8.9 |
-0.71 |
0 |
|
|
73359 |
48417517 |
1 |
SO3N4C14H14 |
AB3C4D14E14 |
-24.2 |
6.57 |
-9.56 |
-1.66 |
0 |
|
|
73360 |
48417518 |
1 |
O2N5C13H17 |
A2B5C13D17 |
-20.44 |
7.22 |
-9.41 |
-0.88 |
0 |
|
|
73361 |
48417521 |
1 |
ClO2F3N5H7C12 |
AB2C3D5E7F12 |
-132.43 |
4.66 |
-9.55 |
-1.76 |
0 |
|
|
73362 |
48417522 |
1 |
OCl2N6H14C17 |
AB2C6D14E17 |
69.62 |
4.0 |
-9.39 |
-1.06 |
0 |
|
|
73363 |
48417524 |
1 |
SO3N6H12C15 |
AB3C6D12E15 |
16.16 |
8.0 |
-9.26 |
-0.88 |
0 |
|
|
73364 |
48417527 |
1 |
SO3N6C15H16 |
AB3C6D15E16 |
-12.75 |
5.89 |
-9.46 |
-1.12 |
0 |
|
|
73365 |
48417528 |
1 |
ON6H12C14 |
AB6C12D14 |
86.98 |
3.19 |
-9.25 |
-1.25 |
0 |
|
|
73366 |
48417530 |
1 |
SO2N6H8C10 |
AB2C6D8E10 |
41.73 |
12.6 |
-8.94 |
-1.66 |
0 |
|
|
73367 |
48417531 |
1 |
FOSN4H9C15 |
ABCD4E9F15 |
43.44 |
6.79 |
-9.3 |
-1.57 |
0 |
|
|
73368 |
48417536 |
1 |
O2F3N4H9C13 |
A2B3C4D9E13 |
-131.35 |
6.3 |
-9.49 |
-1.27 |
0 |
|
|
73369 |
48417541 |
1 |
ON8H14C16 |
AB8C14D16 |
119.5 |
7.74 |
-9.56 |
-1.34 |
0 |
|
|
73370 |
48417542 |
1 |
ClON6H9C14 |
ABC6D9E14 |
98.8 |
3.48 |
-9.51 |
-1.46 |
0 |
|
|
73371 |
48417545 |
1 |
O2N4H10C11 |
A2B4C10D11 |
22.66 |
6.3 |
-9.3 |
-1.23 |
0 |
|
|
73372 |
48417546 |
1 |
O2N5C10H11 |
A2B5C10D11 |
9.32 |
6.05 |
-9.5 |
-1.03 |
0 |
|
|
73373 |
48417548 |
1 |
O2N5C19H21 |
A2B5C19D21 |
-2.08 |
1.38 |
-9.5 |
-1.03 |
0 |
|
|
73374 |
48417551 |
1 |
SO3N6C15H18 |
AB3C6D15E18 |
-25.0 |
7.21 |
-9.36 |
-1.34 |
0 |
|
|
73375 |
48417557 |
1 |
O2N5H11C15 |
A2B5C11D15 |
86.76 |
3.72 |
-9.42 |
-1.69 |
0 |
|
|
73376 |
48417559 |
1 |
FOSN5H12C16 |
ABCD5E12F16 |
30.79 |
2.48 |
-9.18 |
-1.45 |
0 |
|
|
73377 |
48417561 |
1 |
O2N5H15C16 |
A2B5C15D16 |
29.81 |
3.68 |
-9.24 |
-1.23 |
0 |
|
|
73378 |
48417565 |
1 |
SO4N5H9C10 |
AB4C5D9E10 |
-29.4 |
3.36 |
-9.62 |
-1.78 |
0 |
|
|
73379 |
48417566 |
1 |
O3N5H9C11 |
A3B5C9D11 |
-10.39 |
6.17 |
-9.51 |
-1.03 |
0 |
|
|
73380 |
48417568 |
1 |
FO2N5H12C18 |
AB2C5D12E18 |
3.74 |
7.34 |
-9.27 |
-1.13 |
0 |
|
|
73381 |
48417569 |
1 |
O2N5C18H19 |
A2B5C18D19 |
-0.45 |
3.35 |
-9.21 |
-1.22 |
0 |
|
|
73382 |
48417573 |
1 |
OSN5H13C16 |
ABC5D13E16 |
84.25 |
5.15 |
-9.36 |
-1.44 |
0 |
|
|
73383 |
48417575 |
1 |
ON7H11C13 |
AB7C11D13 |
97.18 |
10.21 |
-9.08 |
-1.33 |
0 |
|
|
73384 |
48417579 |
1 |
O3N5H15C16 |
A3B5C15D16 |
-20.52 |
1.58 |
-8.42 |
-1.24 |
0 |
|
|
73385 |
48417580 |
1 |
ON7H11C15 |
AB7C11D15 |
112.61 |
5.54 |
-8.97 |
-1.26 |
0 |
|
|
73386 |
48417584 |
1 |
O2N5H15C18 |
A2B5C15D18 |
30.93 |
7.71 |
-9.36 |
-1.01 |
0 |
|
|
73387 |
48417588 |
1 |
SO3N5C16H17 |
AB3C5D16E17 |
-24.72 |
5.18 |
-9.5 |
-1.49 |
0 |
|
|
73388 |
48417589 |
1 |
S2O3N5H15C18 |
A2B3C5D15E18 |
16.75 |
3.65 |
-9.04 |
-1.57 |
0 |
|
|
73389 |
48417590 |
1 |
S2O3N5H13C16 |
A2B3C5D13E16 |
13.28 |
4.0 |
-8.98 |
-1.23 |
0 |
|
|
73390 |
48417591 |
1 |
O3N6H16C17 |
A3B6C16D17 |
31.97 |
4.75 |
-9.01 |
-1.06 |
0 |
|
|
73391 |
48417592 |
1 |
BrO2N5H12C15 |
AB2C5D12E15 |
20.94 |
2.6 |
-9.2 |
-1.34 |
0 |
|
|
73392 |
48417597 |
1 |
O2N5H17C18 |
A2B5C17D18 |
6.76 |
0.99 |
-8.62 |
-1.2 |
0 |
|
|
73393 |
48417603 |
1 |
ON5H13C15 |
AB5C13D15 |
61.21 |
6.95 |
-8.62 |
-0.71 |
0 |
|
|
73394 |
48417607 |
1 |
ON5H15C16 |
AB5C15D16 |
50.99 |
4.9 |
-8.52 |
-0.68 |
0 |
|
|
73395 |
48417609 |
1 |
SO3N5C15H15 |
AB3C5D15E15 |
5.2 |
5.28 |
-9.49 |
-1.49 |
0 |
|
|
73396 |
48417610 |
1 |
O2N5C13H17 |
A2B5C13D17 |
-27.54 |
0.57 |
-9.6 |
-1.18 |
0 |
|
|
73397 |
48417611 |
1 |
O3N6H18C19 |
A3B6C18D19 |
-34.99 |
0.93 |
-9.28 |
-1.1 |
0 |
|
|
73398 |
48417613 |
1 |
OCl2N5H7C10 |
AB2C5D7E10 |
53.15 |
5.92 |
-9.39 |
-1.39 |
0 |
|
|
73399 |
48417615 |
1 |
O4N5H9C12 |
A4B5C9D12 |
24.95 |
3.05 |
-9.76 |
-1.62 |
0 |
|
|
73400 |
48417616 |
1 |
O2N5C12H15 |
A2B5C12D15 |
-23.01 |
5.42 |
-9.55 |
-1.12 |
0 |
|
|
73401 |
48417617 |
1 |
BrON6H13C16 |
ABC6D13E16 |
98.23 |
5.42 |
-9.33 |
-1.48 |
0 |
|
|
73402 |
48417623 |
2 |
ON2C7H7 |
AB2C7D7 |
22.67 |
5.58 |
-9.4 |
-0.97 |
0 |
|
|
73403 |
48417624 |
1 |
O2N7C16H17 |
A2B7C16D17 |
44.51 |
13.53 |
-9.12 |
-1.26 |
0 |
|
|
73404 |
48417625 |
1 |
ON5H15C20 |
AB5C15D20 |
108.34 |
5.79 |
-8.9 |
-1.26 |
0 |
|
|
73405 |
48417627 |
1 |
OF3N4C12H13 |
AB3C4D12E13 |
-151.67 |
2.54 |
-9.5 |
-1.03 |
0 |
|
|
73406 |
48417633 |
1 |
ON6H18C19 |
AB6C18D19 |
94.77 |
7.56 |
-9.23 |
-0.83 |
0 |
|
|
73407 |
48417634 |
1 |
O2N4C11H14 |
A2B4C11D14 |
-15.57 |
4.89 |
-9.4 |
-0.85 |
0 |
|
|
73408 |
48417637 |
1 |
BrO3N5H12C17 |
AB3C5D12E17 |
19.3 |
6.6 |
-9.14 |
-1.15 |
0 |
|
|
73409 |
48417638 |
1 |
BrO3N4H11C16 |
AB3C4D11E16 |
30.72 |
4.97 |
-9.42 |
-1.52 |
0 |
|
|
73410 |
48417642 |
1 |
O2N4C17H20 |
A2B4C17D20 |
-7.32 |
3.42 |
-8.87 |
-0.96 |
0 |
|
|
73411 |
48417643 |
1 |
BrO3N4H11C16 |
AB3C4D11E16 |
29.48 |
3.62 |
-9.31 |
-1.54 |
0 |
|
|
73412 |
48417644 |
1 |
O2N5C19H21 |
A2B5C19D21 |
-8.44 |
3.4 |
-9.51 |
-1.06 |
0 |
|
|
73413 |
48417646 |
1 |
O2N5H15C16 |
A2B5C15D16 |
10.75 |
7.49 |
-9.11 |
-1.12 |
0 |
|
|
73414 |
48417647 |
1 |
BrO2N5H10C16 |
AB2C5D10E16 |
67.74 |
4.66 |
-9.48 |
-1.54 |
0 |
|
|
73415 |
48417649 |
1 |
OSH4N6C7 |
ABC4D6E7 |
104.17 |
3.12 |
-9.63 |
-1.67 |
0 |
|
|
73416 |
48417654 |
1 |
O2F3N4C20H23 |
A2B3C4D20E23 |
-179.17 |
3.85 |
-9.24 |
-0.99 |
0 |
|
|
73417 |
48417655 |
1 |
OF3N4C22H23 |
AB3C4D22E23 |
-119.4 |
6.76 |
-8.94 |
-0.53 |
0 |
|
|
73418 |
48417658 |
1 |
OF3N5C21H22 |
AB3C5D21E22 |
-95.05 |
7.53 |
-9.1 |
-0.94 |
0 |
|
|
73419 |
48417659 |
1 |
OF3N4C19H23 |
AB3C4D19E23 |
-141.06 |
5.15 |
-9.07 |
-0.44 |
0 |
|
|
73420 |
48417660 |
1 |
N2O2F3C22H25 |
A2B2C3D22E25 |
-199.61 |
5.16 |
-9.01 |
-0.54 |
0 |
|
|
73421 |
48417662 |
1 |
O2F3N3C21H24 |
A2B3C3D21E24 |
-192.27 |
6.08 |
-9.12 |
-0.57 |
0 |
|
|
73422 |
48417663 |
1 |
OF3N3C23H28 |
AB3C3D23E28 |
-159.94 |
6.9 |
-8.43 |
-0.37 |
0 |
|
|
73423 |
48417664 |
1 |
OF3N3C23H28 |
AB3C3D23E28 |
-158.07 |
3.79 |
-8.32 |
-0.52 |
0 |
|
|
73424 |
48417665 |
1 |
ON2F3C22H29 |
AB2C3D22E29 |
-191.11 |
6.83 |
-9.05 |
-0.52 |
0 |
|
|
73425 |
48417666 |
1 |
F3N3O3C20H28 |
A3B3C3D20E28 |
-290.68 |
4.92 |
-9.16 |
-0.52 |
0 |
|
|
73426 |
48417670 |
1 |
O2F3N4C19H21 |
A2B3C4D19E21 |
-176.03 |
4.44 |
-9.37 |
-1.14 |
0 |
|
|
73427 |
48417671 |
1 |
O2F3N3C19H22 |
A2B3C3D19E22 |
-164.7 |
4.37 |
-9.21 |
-0.57 |
0 |
|
|
73428 |
48417673 |
1 |
OF3N4C20H23 |
AB3C4D20E23 |
-142.12 |
7.59 |
-9.15 |
-0.82 |
0 |
|
|
73429 |
48417677 |
1 |
N2O2F3C20H23 |
A2B2C3D20E23 |
-197.16 |
3.93 |
-9.15 |
-0.51 |
0 |
|
|
73430 |
48417678 |
1 |
ON2F5C21H21 |
AB2C5D21E21 |
-252.65 |
7.15 |
-9.24 |
-0.7 |
0 |
|
|
73431 |
48417680 |
1 |
N2O2F3C22H25 |
A2B2C3D22E25 |
-200.21 |
5.38 |
-9.05 |
-0.71 |
0 |
|
|
73432 |
48417681 |
1 |
ClOF3N3C20H21 |
ABC3D3E20F21 |
-154.95 |
1.74 |
-9.34 |
-0.95 |
0 |
|
|
73433 |
48417685 |
1 |
N2O2F3C22H25 |
A2B2C3D22E25 |
-197.69 |
6.54 |
-8.91 |
-0.49 |
0 |
|
|
73434 |
48417688 |
1 |
O2F3N3C20H24 |
A2B3C3D20E24 |
-181.99 |
6.09 |
-9.15 |
-0.78 |
0 |
|
|
73435 |
48417692 |
1 |
ClON3C22H22 |
ABC3D22E22 |
14.63 |
3.72 |
-8.13 |
-0.26 |
0 |
|
|
73436 |
48417694 |
1 |
ClO2N3H18C19 |
AB2C3D18E19 |
11.83 |
2.44 |
-8.19 |
-0.96 |
0 |
|
|
73437 |
48417695 |
1 |
ON2F5C21H21 |
AB2C5D21E21 |
-252.46 |
7.18 |
-9.21 |
-0.65 |
0 |
|
|
73438 |
48417698 |
1 |
N2O2F3C23H23 |
A2B2C3D23E23 |
-170.13 |
3.0 |
-9.17 |
-0.67 |
0 |
|
|
73439 |
48417702 |
1 |
O2F3N3C20H26 |
A2B3C3D20E26 |
-216.9 |
3.85 |
-9.11 |
-0.69 |
0 |
|
|
73440 |
48417706 |
1 |
ClO2N4H19C20 |
AB2C4D19E20 |
-4.24 |
5.04 |
-8.18 |
-1.18 |
0 |
|
|
73441 |
48417707 |
1 |
ClO2N3C22H24 |
AB2C3D22E24 |
-16.55 |
3.77 |
-8.14 |
-0.16 |
0 |
|
|
73442 |
48417708 |
1 |
ClSO2N3C21H22 |
ABC2D3E21F22 |
-49.27 |
4.12 |
-8.2 |
-0.34 |
0 |
|
|
73443 |
48417709 |
1 |
ClON4C22H25 |
ABC4D22E25 |
8.82 |
6.79 |
-8.01 |
-0.02 |
0 |
|
|
73444 |
48417714 |
1 |
ClON5H18C21 |
ABC5D18E21 |
72.24 |
7.58 |
-7.96 |
-1.55 |
0 |
|
|
73445 |
48417715 |
1 |
ClO2N4H17C19 |
AB2C4D17E19 |
-3.38 |
4.66 |
-8.23 |
-1.33 |
0 |
|
|
73446 |
48417724 |
1 |
ClSO2N4C20H21 |
ABC2D4E20F21 |
9.26 |
3.38 |
-8.22 |
-0.55 |
0 |
|
|
73447 |
48417725 |
1 |
ClO2N4C22H23 |
AB2C4D22E23 |
-15.17 |
3.9 |
-8.59 |
-1.23 |
0 |
|
|
73448 |
48417727 |
1 |
ClOSN3H18C19 |
ABCD3E18F19 |
21.89 |
4.8 |
-8.14 |
-1.21 |
0 |
|
|
73449 |
48417733 |
1 |
SN2O3C20H32 |
AB2C3D20E32 |
-154.23 |
6.85 |
-8.74 |
-0.04 |
0 |
|
|
73450 |
48417738 |
1 |
SN3O3C21H25 |
AB3C3D21E25 |
-78.27 |
6.09 |
-8.51 |
-0.2 |
0 |
|
|
73451 |
48417747 |
1 |
N2S2O3C20H22 |
A2B2C3D20E22 |
-82.99 |
5.94 |
-8.7 |
-1.0 |
0 |