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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
88429 |
49903495 |
1 |
BrClSN2O4H18C25 |
ABCD2E4F18G25 |
-77.77 |
0.89 |
-9.1 |
-1.6 |
0 |
|
|
88430 |
49903500 |
1 |
BrSN3O8H14C24 |
ABC3D8E14F24 |
-68.9 |
3.55 |
-9.69 |
-2.47 |
0 |
|
|
88431 |
49903501 |
1 |
FNSBr2O2H10C17 |
ABCD2E2F10G17 |
-59.18 |
2.08 |
-9.62 |
-1.36 |
0 |
|
|
88432 |
49903506 |
1 |
BrNSCl2O2H10C17 |
ABCD2E2F10G17 |
-31.32 |
2.06 |
-9.6 |
-1.33 |
0 |
|
|
88433 |
49903507 |
1 |
BrSN2O6H21C26 |
ABC2D6E21F26 |
-77.7 |
4.05 |
-8.88 |
-1.42 |
0 |
|
|
88434 |
49903510 |
1 |
BrSN2O2H21C27 |
ABC2D2E21F27 |
11.37 |
8.33 |
-8.65 |
-1.01 |
0 |
|
|
88435 |
49903511 |
1 |
BrSN2O6H23C24 |
ABC2D6E23F24 |
-172.19 |
1.34 |
-9.08 |
-1.27 |
0 |
|
|
88436 |
49903525 |
1 |
BrINSO4H17C21 |
ABCDE4F17G21 |
-53.94 |
1.67 |
-8.74 |
-1.21 |
0 |
|
|
88437 |
49903534 |
1 |
BrSN2O2H21C27 |
ABC2D2E21F27 |
12.34 |
8.68 |
-8.65 |
-1.03 |
0 |
|
|
88438 |
49903536 |
1 |
BrNSCl2O4H18C25 |
ABCD2E4F18G25 |
-84.44 |
4.41 |
-8.74 |
-1.08 |
0 |
|
|
88439 |
49903543 |
1 |
BrSN2O4H21C26 |
ABC2D4E21F26 |
-77.72 |
3.85 |
-8.83 |
-1.33 |
0 |
|
|
88440 |
49903544 |
1 |
ClFNSBr2O3H15C24 |
ABCDE2F3G15H24 |
-77.1 |
4.37 |
-9.26 |
-0.97 |
0 |
|
|
88441 |
49903545 |
1 |
NSBr2Cl2O3H15C24 |
ABC2D2E3F15G24 |
-47.05 |
3.48 |
-9.32 |
-1.34 |
0 |
|
|
88442 |
49903546 |
1 |
BrINSO4H21C26 |
ABCDE4F21G26 |
-55.25 |
5.71 |
-8.86 |
-1.25 |
0 |
|
|
88443 |
49903547 |
1 |
BrN2S2O6H21C29 |
AB2C2D6E21F29 |
-144.08 |
7.82 |
-8.8 |
-1.06 |
0 |
|
|
88444 |
49903549 |
1 |
BrSN2O4H19C24 |
ABC2D4E19F24 |
-54.14 |
2.91 |
-8.91 |
-1.19 |
0 |
|
|
88445 |
49903552 |
1 |
BrSN2O2H23C25 |
ABC2D2E23F25 |
-25.03 |
10.8 |
-8.53 |
-0.88 |
0 |
|
|
88446 |
49903555 |
1 |
NSBr2O5H17C25 |
ABC2D5E17F25 |
-94.15 |
6.35 |
-9.37 |
-1.37 |
0 |
|
|
88447 |
49903556 |
1 |
BrSN2O4H21C25 |
ABC2D4E21F25 |
-91.05 |
4.66 |
-8.61 |
-1.31 |
0 |
|
|
88448 |
49903559 |
1 |
ClSN2O6H21C29 |
ABC2D6E21F29 |
-57.38 |
4.21 |
-8.89 |
-1.48 |
0 |
|
|
88449 |
49903562 |
1 |
S2N3O9H21C26 |
A2B3C9D21E26 |
-200.85 |
5.28 |
-8.91 |
-1.34 |
0 |
|
|
88450 |
49903574 |
1 |
BrSN2O6H13C18 |
ABC2D6E13F18 |
-95.96 |
7.38 |
-9.15 |
-1.55 |
0 |
|
|
88451 |
49903576 |
1 |
ClSN2O6H23C30 |
ABC2D6E23F30 |
-64.17 |
6.07 |
-8.91 |
-1.52 |
0 |
|
|
88452 |
49903584 |
1 |
BrS2N3O4H22C29 |
AB2C3D4E22F29 |
19.99 |
7.3 |
-8.82 |
-1.63 |
0 |
|
|
88453 |
49903590 |
1 |
BrSN2O8H17C21 |
ABC2D8E17F21 |
-167.17 |
5.82 |
-9.07 |
-1.36 |
0 |
|
|
88454 |
49903591 |
1 |
BrSN2O5H17C24 |
ABC2D5E17F24 |
-28.66 |
9.23 |
-9.47 |
-1.28 |
0 |
|
|
88455 |
49903600 |
1 |
BrSN3O7H16C24 |
ABC3D7E16F24 |
-33.63 |
9.2 |
-9.37 |
-1.92 |
0 |
|
|
88456 |
49903603 |
1 |
BrSN2O4H21C25 |
ABC2D4E21F25 |
-79.6 |
9.93 |
-8.4 |
-0.77 |
0 |
|
|
88457 |
49903609 |
1 |
FSN2O6H19C25 |
ABC2D6E19F25 |
-116.98 |
5.62 |
-8.88 |
-1.39 |
0 |
|
|
88458 |
49903611 |
1 |
BrSN2O5H11C17 |
ABC2D5E11F17 |
-60.88 |
6.92 |
-9.48 |
-1.54 |
0 |
|
|
88459 |
49903614 |
1 |
BrSN3O7H16C24 |
ABC3D7E16F24 |
-32.1 |
8.23 |
-9.5 |
-1.81 |
0 |
|
|
88460 |
49903615 |
1 |
SN4O8H16C23 |
AB4C8D16E23 |
-49.59 |
8.84 |
-9.41 |
-1.8 |
0 |
|
|
88461 |
49903622 |
1 |
FSN2O7H17C25 |
ABC2D7E17F25 |
-149.19 |
9.67 |
-9.02 |
-1.37 |
0 |
|
|
88462 |
49903625 |
1 |
SN3O7H17C24 |
AB3C7D17E24 |
-38.31 |
4.93 |
-9.54 |
-1.68 |
0 |
|
|
88463 |
49903629 |
1 |
SBr2N2O6H12C18 |
AB2C2D6E12F18 |
-88.89 |
5.04 |
-9.24 |
-1.59 |
0 |
|
|
88464 |
49903630 |
1 |
SBr2N2O5H12C18 |
AB2C2D5E12F18 |
-47.4 |
6.11 |
-9.4 |
-1.53 |
0 |
|
|
88465 |
49903632 |
1 |
ClSN2O8H19C26 |
ABC2D8E19F26 |
-154.41 |
8.72 |
-9.28 |
-1.54 |
0 |
|
|
88466 |
49903633 |
1 |
BrSN2O6H15C24 |
ABC2D6E15F24 |
-65.74 |
5.92 |
-9.75 |
-1.32 |
0 |
|
|
88467 |
49903634 |
1 |
SN2O5H20C28 |
AB2C5D20E28 |
-17.72 |
9.9 |
-9.19 |
-1.34 |
0 |
|
|
88468 |
49903638 |
1 |
BrS2N3O8H18C25 |
AB2C3D8E18F25 |
-159.5 |
14.08 |
-9.16 |
-1.37 |
0 |
|
|
88469 |
49903639 |
1 |
SN2O4H14C18 |
AB2C4D14E18 |
-28.11 |
5.58 |
-9.66 |
-1.31 |
0 |
|
|
88470 |
49903640 |
1 |
SN2O4H14C18 |
AB2C4D14E18 |
-28.39 |
5.95 |
-9.65 |
-1.27 |
0 |
|
|
88471 |
49903642 |
1 |
BrSN2O6H15C19 |
ABC2D6E15F19 |
-90.41 |
8.22 |
-8.94 |
-1.42 |
0 |
|
|
88472 |
49903644 |
1 |
BrSN2O4H19C25 |
ABC2D4E19F25 |
-69.06 |
2.7 |
-9.02 |
-1.14 |
0 |
|
|
88473 |
49903680 |
1 |
ISN2O7H19C26 |
ABC2D7E19F26 |
-97.47 |
8.66 |
-9.32 |
-1.52 |
0 |
|
|
88474 |
49903683 |
1 |
FISN2O6H18C25 |
ABCD2E6F18G25 |
-97.42 |
5.18 |
-9.01 |
-1.54 |
0 |
|
|
88475 |
49903684 |
1 |
ClSN2O5H17C24 |
ABC2D5E17F24 |
-37.45 |
2.98 |
-9.06 |
-1.34 |
0 |
|
|
88476 |
49903685 |
1 |
BrClSN2O4H18C25 |
ABCD2E4F18G25 |
-81.12 |
3.17 |
-9.08 |
-1.35 |
0 |
|
|
88477 |
49903686 |
1 |
SN2O7H18C25 |
AB2C7D18E25 |
-103.94 |
7.84 |
-9.09 |
-1.34 |
0 |
|
|
88478 |
49903695 |
1 |
BrClSN2O5H20C26 |
ABCD2E5F20G26 |
-113.14 |
4.95 |
-8.87 |
-1.48 |
0 |
|
|
88479 |
49903696 |
1 |
ClSN4O5H17C24 |
ABC4D5E17F24 |
-4.17 |
12.94 |
-8.98 |
-2.05 |
0 |
|
|
88480 |
49903703 |
1 |
ClN2S2O8H19C25 |
AB2C2D8E19F25 |
-156.04 |
10.62 |
-9.17 |
-1.29 |
0 |
|
|
88481 |
49903710 |
1 |
BrSN3O8H18C25 |
ABC3D8E18F25 |
-69.74 |
7.47 |
-9.31 |
-1.68 |
0 |
|
|
88482 |
49903711 |
1 |
ClN2S2O7H15C23 |
AB2C2D7E15F23 |
-119.55 |
2.93 |
-9.32 |
-1.47 |
0 |
|
|
88483 |
49903720 |
1 |
SN3O7H17C24 |
AB3C7D17E24 |
-54.85 |
3.92 |
-9.51 |
-2.08 |
0 |
|
|
88484 |
49903735 |
1 |
SN2O6H24C27 |
AB2C6D24E27 |
-85.42 |
7.17 |
-8.7 |
-1.37 |
0 |
|
|
88485 |
49903747 |
1 |
ClSN3O6H20C26 |
ABC3D6E20F26 |
-86.8 |
9.74 |
-9.25 |
-1.3 |
0 |
|
|
88486 |
49903762 |
1 |
S2N3O10H17C24 |
A2B3C10D17E24 |
-139.63 |
12.36 |
-9.06 |
-2.08 |
0 |
|
|
88487 |
49903764 |
1 |
BrClISN2O5H21C27 |
ABCDE2F5G21H27 |
-101.96 |
3.79 |
-9.36 |
-1.35 |
0 |
|
|
88488 |
49903765 |
1 |
ClSN2O5H17C24 |
ABC2D5E17F24 |
-41.85 |
7.77 |
-9.46 |
-1.44 |
0 |
|
|
88489 |
49903785 |
1 |
BrSN2O4H21C26 |
ABC2D4E21F26 |
-80.36 |
2.2 |
-8.94 |
-1.32 |
0 |
|
|
88490 |
49903847 |
1 |
SN2O5H10C15 |
AB2C5D10E15 |
-51.97 |
7.33 |
-9.36 |
-1.73 |
0 |
|
|
88491 |
49903848 |
1 |
SCl2N2O6H14C24 |
AB2C2D6E14F24 |
-85.74 |
5.82 |
-9.46 |
-1.52 |
0 |
|
|
88492 |
49903849 |
1 |
ClSN2O6H25C29 |
ABC2D6E25F29 |
-76.55 |
5.91 |
-8.93 |
-1.43 |
0 |
|
|
88493 |
49903856 |
1 |
SCl2N2O7H16C25 |
AB2C2D7E16F25 |
-119.92 |
7.32 |
-9.38 |
-1.54 |
0 |
|
|
88494 |
49903859 |
1 |
SN3O8H23C27 |
AB3C8D23E27 |
-147.4 |
5.75 |
-8.67 |
-1.5 |
0 |
|
|
88495 |
49903863 |
1 |
SBr2N2F3O5H13C24 |
AB2C2D3E5F13G24 |
-181.95 |
7.36 |
-9.76 |
-1.86 |
0 |
|
|
88496 |
49903864 |
1 |
NSBr2O4H25C29 |
ABC2D4E25F29 |
-61.52 |
3.54 |
-8.73 |
-1.02 |
0 |
|
|
88497 |
49903866 |
1 |
BrClNSO5H17C25 |
ABCDE5F17G25 |
-109.32 |
4.67 |
-9.17 |
-1.36 |
0 |
|
|
88498 |
49903874 |
1 |
SN3O7H15C22 |
AB3C7D15E22 |
-37.84 |
11.12 |
-9.12 |
-1.82 |
0 |
|
|
88499 |
49903895 |
1 |
ClSN2O6H15C19 |
ABC2D6E15F19 |
-115.53 |
3.02 |
-9.1 |
-1.53 |
0 |
|
|
88500 |
49903901 |
1 |
BrClSN2O5H16C24 |
ABCD2E5F16G24 |
-37.74 |
5.01 |
-9.44 |
-1.31 |
0 |
|
|
88501 |
49903916 |
1 |
SN3O8C25H25 |
AB3C8D25E25 |
-179.02 |
4.57 |
-9.26 |
-1.52 |
0 |
|
|
88502 |
49903919 |
1 |
SN2O5H16C19 |
AB2C5D16E19 |
-66.65 |
7.58 |
-9.15 |
-1.24 |
0 |
|
|
88503 |
49903920 |
1 |
BrSN2O6H19C22 |
ABC2D6E19F22 |
-80.18 |
7.26 |
-9.01 |
-1.55 |
0 |
|
|
88504 |
49903922 |
1 |
BrClN2S2O7H14C23 |
ABC2D2E7F14G23 |
-114.53 |
9.17 |
-9.47 |
-1.54 |
0 |
|
|
88505 |
49903943 |
1 |
SN3O9H15C20 |
AB3C9D15E20 |
-145.6 |
7.27 |
-9.51 |
-1.65 |
0 |
|
|
88506 |
49903946 |
1 |
ClSN2O6H21C26 |
ABC2D6E21F26 |
-82.37 |
9.82 |
-8.93 |
-1.44 |
0 |
|
|
88507 |
49903952 |
1 |
BrClSN2O5H22C27 |
ABCD2E5F22G27 |
-124.8 |
4.04 |
-8.95 |
-1.43 |
0 |
|
|
88508 |
49903962 |
1 |
S2N3O9H23C27 |
A2B3C9D23E27 |
-205.29 |
14.75 |
-8.74 |
-1.27 |
0 |
|
|
88509 |
49903966 |
1 |
ClS2N3O9H22C27 |
AB2C3D9E22F27 |
-211.43 |
7.26 |
-8.8 |
-1.25 |
0 |
|
|
88510 |
49903970 |
1 |
SN2O5H20C25 |
AB2C5D20E25 |
-41.8 |
8.47 |
-9.14 |
-1.37 |
0 |
|
|
88511 |
49903978 |
1 |
ClFSN2O6H18C25 |
ABCD2E6F18G25 |
-124.16 |
7.77 |
-8.8 |
-1.25 |
0 |
|
|
88512 |
49903983 |
1 |
BrSN3O8H20C26 |
ABC3D8E20F26 |
-74.03 |
10.43 |
-9.13 |
-1.63 |
0 |
|
|
88513 |
49903984 |
1 |
ClSN2O7H17C25 |
ABC2D7E17F25 |
-113.51 |
8.97 |
-9.15 |
-1.39 |
0 |
|
|
88514 |
49903987 |
1 |
BrSN2O6H21C29 |
ABC2D6E21F29 |
-44.52 |
9.09 |
-8.98 |
-1.41 |
0 |
|
|
88515 |
49903991 |
1 |
BrNSO4H20C25 |
ABCD4E20F25 |
-63.64 |
0.93 |
-8.65 |
-0.98 |
0 |
|
|
88516 |
49904002 |
1 |
SN4O8H16C23 |
AB4C8D16E23 |
-56.87 |
4.05 |
-9.45 |
-1.89 |
0 |
|
|
88517 |
49904003 |
1 |
SCl2N2O7H18C26 |
AB2C2D7E18F26 |
-127.97 |
2.29 |
-9.19 |
-1.71 |
0 |
|
|
88518 |
49904005 |
1 |
ClSN3O7H12C21 |
ABC3D7E12F21 |
-38.96 |
10.1 |
-9.4 |
-2.01 |
-1 |
|
|
88519 |
49955020 |
1 |
ClNO3C19H23 |
ABC3D19E23 |
-29.3 |
2.31 |
0.0 |
0.0 |
-1 |
|
|
88520 |
49955059 |
1 |
ClNOC18H23 |
ABCD18E23 |
17.5 |
0.65 |
0.0 |
0.0 |
-2 |
|
|
88521 |
49955066 |
1 |
FN2O2Cl3C16H20 |
AB2C2D3E16F20 |
-137.45 |
6.02 |
-9.27 |
-1.1 |
-1 |
|
|
88522 |
49955101 |
1 |
ClNO3C21H23 |
ABC3D21E23 |
-26.33 |
3.55 |
0.0 |
0.0 |
-1 |
|
|
88523 |
49955103 |
1 |
OCl2N2H19C20 |
AB2C2D19E20 |
60.65 |
1.89 |
0.0 |
0.0 |
-2 |
|
|
88524 |
49955105 |
1 |
N2O3Cl4C21H26 |
A2B3C4D21E26 |
-89.82 |
3.39 |
-8.69 |
-1.83 |
-1 |
|
|
88525 |
49955131 |
1 |
ClSO2N5C18H23 |
ABC2D5E18F23 |
62.27 |
6.06 |
0.0 |
0.0 |
-2 |
|
|
88527 |
49955148 |
1 |
BrClNO2H18C19 |
ABCD2E18F19 |
30.63 |
4.13 |
0.0 |
0.0 |
-1 |
|
|
88528 |
49955149 |
1 |
OCl2N2H17C18 |
AB2C2D17E18 |
54.1 |
3.03 |
0.0 |
0.0 |
-1 |
|
|
88529 |
49955167 |
1 |
ClON2C15H18 |
ABC2D15E18 |
33.12 |
1.63 |
0.0 |
0.0 |
-1 |