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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
68451 |
46508435 |
2 |
ON2C8H10 |
AB2C8D10 |
-3.07 |
5.86 |
-9.56 |
-1.05 |
0 |
|
|
68452 |
46508436 |
1 |
FNSO4H20C24 |
ABCD4E20F24 |
-108.16 |
4.33 |
-8.18 |
-1.27 |
0 |
|
|
68453 |
46508437 |
1 |
NO3H15C20 |
AB3C15D20 |
-25.95 |
3.72 |
-8.41 |
-1.0 |
0 |
|
|
68454 |
46508441 |
1 |
FSO3N4H21C25 |
ABC3D4E21F25 |
-39.48 |
2.53 |
-9.27 |
-1.41 |
0 |
|
|
68455 |
46508445 |
1 |
ClSO2N5H18C19 |
ABC2D5E18F19 |
18.6 |
8.58 |
-9.15 |
-0.78 |
0 |
|
|
68456 |
46508447 |
1 |
N3O3H21C25 |
A3B3C21D25 |
-2.91 |
2.87 |
-8.83 |
-1.0 |
0 |
|
|
68457 |
46508449 |
1 |
N4O5H24C25 |
A4B5C24D25 |
-53.17 |
6.88 |
-8.74 |
-1.4 |
0 |
|
|
68458 |
46508450 |
1 |
OSN4C22H26 |
ABC4D22E26 |
22.85 |
8.59 |
-9.01 |
-0.69 |
0 |
|
|
68459 |
46508451 |
1 |
FSO2N3H20C24 |
ABC2D3E20F24 |
-7.2 |
2.07 |
-8.64 |
-1.3 |
0 |
|
|
68460 |
46508453 |
2 |
ClON2H8C9 |
ABC2D8E9 |
9.36 |
4.59 |
-9.88 |
-1.13 |
0 |
|
|
68461 |
46508459 |
2 |
ON2C12H15 |
AB2C12D15 |
-6.29 |
5.73 |
-9.4 |
-1.06 |
0 |
|
|
68462 |
46508460 |
1 |
N3O3H21C26 |
A3B3C21D26 |
13.84 |
2.8 |
-9.21 |
-1.36 |
0 |
|
|
68463 |
46508462 |
1 |
FSN2O4H23C26 |
ABC2D4E23F26 |
-117.32 |
3.89 |
-8.57 |
-1.04 |
0 |
|
|
68464 |
46508464 |
1 |
FSN2O2H23C25 |
ABC2D2E23F25 |
-53.84 |
3.31 |
-8.98 |
-1.06 |
0 |
|
|
68465 |
46508468 |
1 |
FN2O3H23C26 |
AB2C3D23E26 |
-87.34 |
7.28 |
-8.67 |
-0.48 |
0 |
|
|
68466 |
46508469 |
1 |
FSN2O2H25C26 |
ABC2D2E25F26 |
-53.33 |
5.97 |
-9.05 |
-0.99 |
0 |
|
|
68467 |
46508471 |
2 |
FN2O2C10H10 |
AB2C2D10E10 |
-157.14 |
2.89 |
-9.28 |
-1.16 |
0 |
|
|
68468 |
46508472 |
1 |
SN3O6C22H29 |
AB3C6D22E29 |
-210.08 |
4.93 |
-8.96 |
-0.72 |
0 |
|
|
68469 |
46508478 |
1 |
FSN2O3C13H17 |
ABC2D3E13F17 |
-164.09 |
3.59 |
-8.8 |
-0.2 |
0 |
|
|
68470 |
46508480 |
1 |
SCl2N2O3C13H16 |
AB2C2D3E13F16 |
-133.77 |
3.33 |
-9.09 |
-0.62 |
0 |
|
|
68471 |
46508483 |
1 |
O2N3C22H27 |
A2B3C22D27 |
-60.01 |
4.15 |
-8.3 |
-0.58 |
0 |
|
|
68472 |
46508487 |
1 |
SN3O4C24H33 |
AB3C4D24E33 |
-148.68 |
6.65 |
-8.85 |
-0.66 |
0 |
|
|
68473 |
46508490 |
1 |
BrSN3O4C21H26 |
ABC3D4E21F26 |
-130.56 |
2.69 |
-9.13 |
-0.79 |
0 |
|
|
68474 |
46508491 |
1 |
SF2N3O5C21H25 |
AB2C3D5E21F25 |
-272.38 |
5.3 |
-9.23 |
-0.8 |
0 |
|
|
68475 |
46508493 |
1 |
SN4O5C24H30 |
AB4C5D24E30 |
-152.75 |
7.76 |
-9.15 |
-0.95 |
0 |
|
|
68476 |
46508495 |
1 |
ClFSN3O4C20H23 |
ABCD3E4F20G23 |
-179.3 |
6.86 |
-9.2 |
-0.77 |
0 |
|
|
68477 |
46508496 |
1 |
SN3O4C22H27 |
AB3C4D22E27 |
-125.22 |
7.95 |
-9.05 |
-0.36 |
0 |
|
|
68478 |
46508497 |
1 |
SN3O4C23H29 |
AB3C4D23E29 |
-135.48 |
9.39 |
-8.94 |
-0.36 |
0 |
|
|
68479 |
46508499 |
1 |
SF2N3O4C20H23 |
AB2C3D4E20F23 |
-217.75 |
5.3 |
-9.45 |
-0.9 |
0 |
|
|
68480 |
46508500 |
1 |
FSN3O4C21H26 |
ABC3D4E21F26 |
-183.19 |
4.12 |
-9.11 |
-0.74 |
0 |
|
|
68481 |
46508501 |
1 |
S2N3O4C21H27 |
A2B3C4D21E27 |
-124.12 |
6.63 |
-9.28 |
-0.53 |
0 |
|
|
68482 |
46508503 |
1 |
SN2O4C19H22 |
AB2C4D19E22 |
-124.5 |
2.77 |
-8.9 |
-0.25 |
0 |
|
|
68483 |
46508504 |
1 |
ClSN2O3C14H19 |
ABC2D3E14F19 |
-134.38 |
5.86 |
-9.05 |
-0.35 |
0 |
|
|
68484 |
46508506 |
1 |
SN2O3C16H24 |
AB2C3D16E24 |
-130.52 |
5.91 |
-8.91 |
-0.28 |
0 |
|
|
68485 |
46508507 |
1 |
SN3O4C24H27 |
AB3C4D24E27 |
-109.95 |
5.72 |
-8.84 |
-0.7 |
0 |
|
|
68486 |
46508508 |
1 |
SN3O4C22H29 |
AB3C4D22E29 |
-140.15 |
5.06 |
-8.91 |
-0.63 |
0 |
|
|
68487 |
46508509 |
1 |
SN3O4C22H29 |
AB3C4D22E29 |
-141.73 |
9.96 |
-8.95 |
-0.33 |
0 |
|
|
68488 |
46508512 |
1 |
SN4O5C17H26 |
AB4C5D17E26 |
-204.53 |
11.02 |
-9.02 |
-0.47 |
0 |
|
|
68489 |
46508514 |
1 |
S2N3O4C22H27 |
A2B3C4D22E27 |
-120.13 |
4.4 |
-8.61 |
-0.67 |
0 |
|
|
68490 |
46508515 |
1 |
S2N4O5C21H28 |
A2B4C5D21E28 |
-173.99 |
6.71 |
-9.27 |
-0.68 |
0 |
|
|
68491 |
46508516 |
1 |
SCl2N3O4C20H23 |
AB2C3D4E20F23 |
-139.15 |
5.64 |
-9.3 |
-0.83 |
0 |
|
|
68492 |
46508519 |
1 |
SN4O7C21H26 |
AB4C7D21E26 |
-169.54 |
8.63 |
-9.2 |
-1.78 |
0 |
|
|
68493 |
46508520 |
1 |
BrSN3O4C20H24 |
ABC3D4E20F24 |
-129.81 |
5.17 |
-9.35 |
-0.71 |
0 |
|
|
68494 |
46508521 |
1 |
SN3O4C21H33 |
AB3C4D21E33 |
-178.71 |
6.83 |
-9.06 |
-0.58 |
0 |
|
|
68495 |
46508522 |
1 |
SN2O3C19H22 |
AB2C3D19E22 |
-90.17 |
5.0 |
-8.71 |
-0.56 |
0 |
|
|
68496 |
46508524 |
1 |
F3N3O4C22H26 |
A3B3C4D22E26 |
-254.87 |
2.87 |
-8.31 |
-0.76 |
0 |
|
|
68497 |
46508525 |
1 |
SN4O5C17H24 |
AB4C5D17E24 |
-191.05 |
10.51 |
-9.05 |
-0.39 |
0 |
|
|
68498 |
46508527 |
1 |
SN2O4C24H32 |
AB2C4D24E32 |
-156.22 |
9.43 |
-8.83 |
-0.36 |
0 |
|
|
68499 |
46508530 |
1 |
SN2O3C16H24 |
AB2C3D16E24 |
-131.2 |
8.18 |
-9.44 |
-0.08 |
0 |
|
|
68500 |
46508535 |
1 |
SN3O4C14H19 |
AB3C4D14E19 |
-164.29 |
1.66 |
-8.69 |
-0.41 |
0 |
|
|
68501 |
46508536 |
1 |
BrFSN2O3C13H16 |
ABCD2E3F13G16 |
-159.31 |
4.98 |
-9.13 |
-0.64 |
0 |
|
|
68502 |
46508538 |
3 |
NOSC7H7 |
ABCD7E7 |
-17.93 |
5.45 |
-8.97 |
-1.06 |
0 |
|
|
68503 |
46508539 |
1 |
FON2C20H23 |
ABC2D20E23 |
-51.97 |
3.75 |
-9.01 |
-0.09 |
0 |
|
|
68504 |
46508541 |
1 |
ClN2O3C19H21 |
AB2C3D19E21 |
-80.12 |
1.8 |
-8.47 |
-0.41 |
0 |
|
|
68505 |
46508542 |
1 |
SF3N3O3C18H18 |
AB3C3D3E18F18 |
-191.95 |
2.86 |
-9.22 |
-0.82 |
0 |
|
|
68506 |
46508543 |
1 |
N2O6C19H20 |
A2B6C19D20 |
-107.87 |
6.62 |
-8.7 |
-1.19 |
0 |
|
|
68507 |
46508546 |
1 |
ClO3N4C19H25 |
AB3C4D19E25 |
-49.39 |
4.04 |
-9.0 |
-0.25 |
0 |
|
|
68508 |
46508549 |
1 |
O3N4C13H22 |
A3B4C13D22 |
-88.29 |
5.78 |
-9.44 |
-0.24 |
0 |
|
|
68509 |
46508553 |
1 |
N2O4C23H30 |
A2B4C23D30 |
-126.15 |
2.41 |
-8.28 |
0.23 |
0 |
|
|
68510 |
46508556 |
1 |
FN3O3C16H20 |
AB3C3D16E20 |
-82.14 |
6.64 |
-8.86 |
-0.08 |
0 |
|
|
68511 |
46508557 |
1 |
ClO2N4C23H23 |
AB2C4D23E23 |
-12.0 |
5.27 |
-8.98 |
-0.57 |
0 |
|
|
68512 |
46508559 |
1 |
SN2O7C23H28 |
AB2C7D23E28 |
-267.99 |
8.66 |
-8.89 |
-0.87 |
0 |
|
|
68513 |
46508560 |
1 |
N2O4C25H28 |
A2B4C25D28 |
-88.3 |
3.6 |
-8.59 |
-0.61 |
0 |
|
|
68514 |
46508562 |
1 |
N2S2O3C18H22 |
A2B2C3D18E22 |
-84.01 |
8.49 |
-8.9 |
-0.29 |
0 |
|
|
68515 |
46508566 |
1 |
F2N2O3C18H18 |
A2B2C3D18E18 |
-156.46 |
1.97 |
-8.84 |
-0.48 |
0 |
|
|
68516 |
46508569 |
1 |
SN3O3C18H21 |
AB3C3D18E21 |
-46.39 |
2.9 |
-8.18 |
-1.22 |
0 |
|
|
68517 |
46508570 |
1 |
N2S2O4C19H24 |
A2B2C4D19E24 |
-118.91 |
10.07 |
-8.77 |
-0.25 |
0 |
|
|
68518 |
46508571 |
1 |
F2N3O3C25H25 |
A2B3C3D25E25 |
-161.49 |
5.06 |
-8.85 |
-0.51 |
0 |
|
|
68519 |
46508572 |
1 |
SO2N3C26H27 |
AB2C3D26E27 |
-8.5 |
5.99 |
-8.25 |
-0.64 |
0 |
|
|
68520 |
46508573 |
1 |
O2N4C21H24 |
A2B4C21D24 |
-16.16 |
3.38 |
-8.74 |
-0.37 |
0 |
|
|
68521 |
46508574 |
1 |
SN3O4C23H23 |
AB3C4D23E23 |
-30.47 |
3.66 |
-8.65 |
-0.98 |
0 |
|
|
68522 |
46508581 |
1 |
N2S2Cl3O3C17H17 |
A2B2C3D3E17F17 |
-96.89 |
7.34 |
-9.22 |
-1.14 |
0 |
|
|
68523 |
46508585 |
1 |
ClN2O3C18H19 |
AB2C3D18E19 |
-75.7 |
4.36 |
-8.91 |
-0.35 |
0 |
|
|
68524 |
46508586 |
1 |
F3N3O4C23H26 |
A3B3C4D23E26 |
-259.52 |
2.9 |
-8.88 |
-0.88 |
0 |
|
|
68525 |
46508588 |
1 |
NS2O4C21H23 |
AB2C4D21E23 |
-113.91 |
2.66 |
-9.36 |
-1.03 |
0 |
|
|
68526 |
46508590 |
1 |
SO2N3C16H21 |
AB2C3D16E21 |
-6.38 |
4.73 |
-8.76 |
-0.36 |
0 |
|
|
68527 |
46508591 |
1 |
ClO2N4C21H25 |
AB2C4D21E25 |
-24.43 |
5.07 |
-8.82 |
-0.35 |
0 |
|
|
68528 |
46508594 |
1 |
O4N5C26H27 |
A4B5C26D27 |
-72.69 |
1.22 |
-8.65 |
-0.62 |
0 |
|
|
68529 |
46508595 |
1 |
N2O4C19H22 |
A2B4C19D22 |
-103.83 |
4.34 |
-8.39 |
-0.11 |
0 |
|
|
68530 |
46508596 |
1 |
NS2O4C21H23 |
AB2C4D21E23 |
-116.3 |
6.08 |
-9.19 |
-1.03 |
0 |
|
|
68531 |
46508597 |
1 |
N2S2O3C19H24 |
A2B2C3D19E24 |
-83.12 |
7.86 |
-9.38 |
-0.42 |
0 |
|
|
68532 |
46508598 |
1 |
N2S2O3C20H26 |
A2B2C3D20E26 |
-88.32 |
8.67 |
-9.07 |
-0.13 |
0 |
|
|
68533 |
46508599 |
1 |
Cl2N2S2O3C17H18 |
A2B2C2D3E17F18 |
-88.69 |
5.24 |
-9.37 |
-0.66 |
0 |
|
|
68534 |
46508600 |
1 |
O3N4C24H30 |
A3B4C24D30 |
-104.65 |
4.38 |
-8.99 |
-0.56 |
0 |
|
|
68535 |
46508604 |
1 |
Cl2N2O4C19H20 |
A2B2C4D19E20 |
-132.14 |
4.81 |
-8.65 |
-0.39 |
0 |
|
|
68536 |
46508607 |
1 |
N2O5H22C26 |
A2B5C22D26 |
-101.57 |
3.17 |
-8.62 |
-1.86 |
0 |
|
|
68537 |
46508608 |
1 |
FSN2O3C24H27 |
ABC2D3E24F27 |
-94.29 |
1.25 |
-8.23 |
-0.32 |
0 |
|
|
68538 |
46508609 |
1 |
S2N3O5C17H19 |
A2B3C5D17E19 |
-84.2 |
5.75 |
-9.42 |
-1.43 |
0 |
|
|
68539 |
46508610 |
2 |
NSO2C12H12 |
ABC2D12E12 |
-86.04 |
3.54 |
-9.18 |
-0.98 |
0 |
|
|
68540 |
46508611 |
1 |
SN3O3C20H23 |
AB3C3D20E23 |
-43.76 |
4.83 |
-8.98 |
-0.57 |
0 |
|
|
68541 |
46508612 |
1 |
N3O3C12H19 |
A3B3C12D19 |
-76.54 |
5.81 |
-9.33 |
-0.13 |
0 |
|
|
68542 |
46508613 |
1 |
O2N4C29H34 |
A2B4C29D34 |
-24.76 |
8.25 |
-7.57 |
-0.62 |
0 |
|
|
68543 |
46508614 |
1 |
O3N4C28H30 |
A3B4C28D30 |
-37.65 |
6.63 |
-9.01 |
-0.67 |
0 |
|
|
68544 |
46508615 |
1 |
N4O5C18H22 |
A4B5C18D22 |
-162.23 |
4.52 |
-8.44 |
-0.48 |
0 |
|
|
68545 |
46508616 |
1 |
ClN3O5C18H18 |
AB3C5D18E18 |
-79.35 |
9.4 |
-9.12 |
-1.38 |
0 |
|
|
68546 |
46508618 |
1 |
N2S2O3C11H16 |
A2B2C3D11E16 |
-99.99 |
7.8 |
-9.32 |
-0.44 |
0 |
|
|
68547 |
46508619 |
1 |
N2S2F3O3C18H19 |
A2B2C3D3E18F19 |
-237.86 |
7.13 |
-9.38 |
-0.62 |
0 |
|
|
68548 |
46508620 |
1 |
S2N3O5C19H23 |
A2B3C5D19E23 |
-156.78 |
10.49 |
-8.78 |
-0.42 |
0 |
|
|
68549 |
46508624 |
1 |
N3O5C25H25 |
A3B5C25D25 |
-58.96 |
7.59 |
-8.89 |
-1.15 |
0 |
|
|
68550 |
46508626 |
1 |
N3O3C27H31 |
A3B3C27D31 |
-61.29 |
5.12 |
-8.35 |
-0.44 |
0 |