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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
155589 |
56366110 |
1 |
SN4O4C22H24 |
AB4C4D22E24 |
-87.09 |
6.53 |
-8.93 |
-0.74 |
0 |
|
|
155590 |
56366120 |
1 |
SN3O5C19H21 |
AB3C5D19E21 |
-80.32 |
4.51 |
-9.56 |
-1.49 |
0 |
|
|
155591 |
56366124 |
1 |
S2N3O3C21H25 |
A2B3C3D21E25 |
-92.01 |
2.39 |
-8.54 |
-0.88 |
0 |
|
|
155592 |
56366128 |
1 |
FO2N4C22H27 |
AB2C4D22E27 |
-84.75 |
6.23 |
-9.26 |
-1.0 |
0 |
|
|
155593 |
56366146 |
1 |
O3N4H24C25 |
A3B4C24D25 |
-42.87 |
6.67 |
-8.71 |
-0.43 |
0 |
|
|
155594 |
56366152 |
1 |
SO4N6C23H28 |
AB4C6D23E28 |
-100.63 |
8.04 |
-9.18 |
-0.72 |
0 |
|
|
155595 |
56366164 |
1 |
FSN2O4H25C27 |
ABC2D4E25F27 |
-136.23 |
3.38 |
-8.64 |
-0.55 |
0 |
|
|
155596 |
56366168 |
1 |
O3N6C22H24 |
A3B6C22D24 |
-43.2 |
7.8 |
-9.54 |
-0.7 |
0 |
|
|
155597 |
56366175 |
1 |
BrO2N5H18C19 |
AB2C5D18E19 |
18.87 |
2.75 |
-9.46 |
-1.22 |
0 |
|
|
155598 |
56366176 |
1 |
BrClN3O3C18H19 |
ABC3D3E18F19 |
-119.89 |
2.52 |
-9.19 |
-0.57 |
0 |
|
|
155599 |
56366184 |
1 |
N4O5C23H24 |
A4B5C23D24 |
-150.73 |
2.39 |
-9.79 |
-1.68 |
0 |
|
|
155600 |
56366186 |
1 |
ClSO2N5H22C23 |
ABC2D5E22F23 |
16.86 |
6.31 |
-8.72 |
-0.72 |
0 |
|
|
155601 |
56366187 |
1 |
SN5O6C22H27 |
AB5C6D22E27 |
-135.15 |
11.03 |
-9.92 |
-1.54 |
0 |
|
|
155602 |
56366188 |
1 |
SN4O4C23H24 |
AB4C4D23E24 |
-80.1 |
2.36 |
-8.87 |
-1.28 |
0 |
|
|
155603 |
56366192 |
1 |
Br2N2O3H12C14 |
A2B2C3D12E14 |
-69.28 |
5.42 |
-8.99 |
-0.87 |
0 |
|
|
155604 |
56366195 |
1 |
BrN3O3C18H22 |
AB3C3D18E22 |
-107.8 |
3.89 |
-9.02 |
-0.44 |
0 |
|
|
155605 |
56366196 |
1 |
BrF3N3O3H13C16 |
AB3C3D3E13F16 |
-230.3 |
8.62 |
-9.06 |
-0.94 |
0 |
|
|
155606 |
56366242 |
1 |
N2S2O3C19H22 |
A2B2C3D19E22 |
-65.69 |
2.02 |
-9.2 |
-0.86 |
0 |
|
|
155607 |
56366255 |
1 |
BrN2O2C21H29 |
AB2C2D21E29 |
-100.03 |
1.11 |
-9.41 |
-0.42 |
0 |
|
|
155608 |
56366262 |
1 |
SN2O4C22H26 |
AB2C4D22E26 |
-134.64 |
6.11 |
-8.84 |
-1.01 |
0 |
|
|
155609 |
56366263 |
1 |
SCl2O2N4C23H26 |
AB2C2D4E23F26 |
-43.92 |
1.79 |
-8.71 |
-0.76 |
0 |
|
|
155610 |
56366281 |
1 |
ClSN4O4C20H23 |
ABC4D4E20F23 |
-118.62 |
3.6 |
-9.2 |
-1.5 |
0 |
|
|
155611 |
56366291 |
1 |
N2S2O4H22C23 |
A2B2C4D22E23 |
-88.38 |
4.12 |
-8.61 |
-0.76 |
0 |
|
|
155612 |
56366294 |
1 |
ClO3N4C21H21 |
AB3C4D21E21 |
-50.1 |
3.44 |
-9.22 |
-1.16 |
0 |
|
|
155613 |
56366299 |
1 |
SN4O4C22H28 |
AB4C4D22E28 |
-129.37 |
2.75 |
-9.59 |
-0.37 |
0 |
|
|
155614 |
56366317 |
1 |
ClSN4O4C21H25 |
ABC4D4E21F25 |
-125.58 |
4.95 |
-9.68 |
-1.21 |
0 |
|
|
155615 |
56366318 |
1 |
IO2N3C16H16 |
AB2C3D16E16 |
-17.45 |
2.16 |
-9.78 |
-1.22 |
0 |
|
|
155616 |
56366321 |
1 |
BrF2N2O2H15C17 |
AB2C2D2E15F17 |
-143.32 |
5.88 |
-9.04 |
-0.62 |
0 |
|
|
155617 |
56366322 |
1 |
BrO2N5H16C18 |
AB2C5D16E18 |
9.93 |
8.29 |
-8.77 |
-1.22 |
0 |
|
|
155618 |
56366324 |
1 |
BrClN3O3H17C20 |
ABC3D3E17F20 |
-63.3 |
5.72 |
-9.08 |
-0.94 |
0 |
|
|
155619 |
56366346 |
1 |
ClOSF2N2H11C17 |
ABCD2E2F11G17 |
-55.52 |
3.89 |
-9.31 |
-1.44 |
0 |
|
|
155620 |
56366350 |
1 |
ClSF2N3O4H20C21 |
ABC2D3E4F20G21 |
-213.09 |
2.19 |
-8.6 |
-1.12 |
0 |
|
|
155621 |
56366352 |
1 |
SN2O4C22H26 |
AB2C4D22E26 |
-125.53 |
4.0 |
-8.56 |
-1.27 |
0 |
|
|
155622 |
56366373 |
1 |
SN2O4C22H28 |
AB2C4D22E28 |
-134.47 |
6.61 |
-8.97 |
-0.54 |
0 |
|
|
155623 |
56366381 |
1 |
F2N3O3C19H25 |
A2B3C3D19E25 |
-229.5 |
7.73 |
-9.67 |
-0.64 |
0 |
|
|
155624 |
56366385 |
1 |
ClO2N4C20H25 |
AB2C4D20E25 |
-53.84 |
7.41 |
-9.4 |
-0.77 |
0 |
|
|
155625 |
56366389 |
1 |
ClO2N4C25H27 |
AB2C4D25E27 |
-18.2 |
1.55 |
-9.11 |
-0.74 |
0 |
|
|
155626 |
56366405 |
1 |
SO3N4H22C23 |
AB3C4D22E23 |
-44.95 |
5.46 |
-8.64 |
-0.57 |
0 |
|
|
155627 |
56366423 |
1 |
O3N4C21H26 |
A3B4C21D26 |
-100.99 |
2.68 |
-9.92 |
-0.54 |
0 |
|
|
155628 |
56366425 |
1 |
BrO2N6C19H19 |
AB2C6D19E19 |
21.83 |
6.34 |
-9.98 |
-1.21 |
0 |
|
|
155629 |
56366430 |
1 |
IN4O4H15C16 |
AB4C4D15E16 |
-20.46 |
5.9 |
-10.26 |
-1.86 |
0 |
|
|
155630 |
56366447 |
1 |
S2N4O4C19H24 |
A2B4C4D19E24 |
-110.9 |
10.02 |
-9.46 |
-0.99 |
0 |
|
|
155631 |
56366471 |
1 |
ClSF2N3O3H14C18 |
ABC2D3E3F14G18 |
-193.46 |
2.45 |
-9.58 |
-1.46 |
0 |
|
|
155632 |
56366480 |
1 |
ClF2N2S2O3H11C15 |
AB2C2D2E3F11G15 |
-102.46 |
6.14 |
-9.32 |
-1.85 |
0 |
|
|
155633 |
56366485 |
1 |
NSO4H19C20 |
ABC4D19E20 |
-81.7 |
5.84 |
-8.77 |
-0.9 |
0 |
|
|
155634 |
56366493 |
1 |
SN4O4C21H24 |
AB4C4D21E24 |
-63.46 |
7.03 |
-9.29 |
-0.86 |
0 |
|
|
155635 |
56366494 |
1 |
FSO4N5C23H26 |
ABC4D5E23F26 |
-136.93 |
1.78 |
-9.19 |
-0.99 |
0 |
|
|
155636 |
56366499 |
1 |
S2N3O4C23H25 |
A2B3C4D23E25 |
-87.32 |
2.71 |
-8.97 |
-0.99 |
0 |
|
|
155637 |
56366506 |
1 |
SN3O4C22H23 |
AB3C4D22E23 |
-113.8 |
7.78 |
-9.23 |
-1.22 |
0 |
|
|
155638 |
56366509 |
1 |
FN3O3C23H26 |
AB3C3D23E26 |
-112.2 |
4.24 |
-9.3 |
-0.93 |
0 |
|
|
155639 |
56366510 |
2 |
ON2C12H16 |
AB2C12D16 |
-57.02 |
8.07 |
-9.13 |
-0.57 |
0 |
|
|
155640 |
56366512 |
1 |
SO2N3C18H29 |
AB2C3D18E29 |
-104.7 |
8.04 |
-9.47 |
-0.8 |
0 |
|
|
155641 |
56366530 |
1 |
O3N5H19C23 |
A3B5C19D23 |
5.74 |
5.91 |
-9.15 |
-1.61 |
0 |
|
|
155642 |
56366554 |
1 |
O2N4C25H26 |
A2B4C25D26 |
-12.37 |
8.17 |
-8.53 |
-0.24 |
0 |
|
|
155643 |
56366557 |
2 |
N2O2C12H15 |
A2B2C12D15 |
-132.92 |
6.06 |
-8.87 |
-0.25 |
0 |
|
|
155644 |
56366564 |
1 |
O3N5C25H25 |
A3B5C25D25 |
-25.66 |
2.91 |
-9.16 |
-0.72 |
0 |
|
|
155645 |
56366568 |
1 |
ClN3O3C18H18 |
AB3C3D18E18 |
-83.43 |
3.73 |
-8.96 |
-0.49 |
0 |
|
|
155646 |
56366580 |
1 |
BrSO2N3H16C18 |
ABC2D3E16F18 |
-14.39 |
10.35 |
-9.06 |
-0.76 |
0 |
|
|
155647 |
56366582 |
1 |
BrN4O4C23H23 |
AB4C4D23E23 |
-135.58 |
7.46 |
-8.81 |
-0.46 |
0 |
|
|
155648 |
56366584 |
1 |
BrN3O3H18C23 |
AB3C3D18E23 |
-42.72 |
10.16 |
-8.51 |
-0.78 |
0 |
|
|
155649 |
56366621 |
1 |
S2N3O3C23H25 |
A2B3C3D23E25 |
-51.87 |
2.18 |
-9.42 |
-0.92 |
0 |
|
|
155650 |
56366627 |
1 |
N3O3S3C21H23 |
A3B3C3D21E23 |
-48.69 |
3.06 |
-8.84 |
-0.76 |
0 |
|
|
155651 |
56366633 |
1 |
SN3O5C23H27 |
AB3C5D23E27 |
-161.11 |
4.71 |
-9.6 |
-0.65 |
0 |
|
|
155652 |
56366634 |
1 |
SN2O5C22H26 |
AB2C5D22E26 |
-167.49 |
6.64 |
-8.92 |
-0.58 |
0 |
|
|
155653 |
56366653 |
1 |
S2N3O4C19H29 |
A2B3C4D19E29 |
-167.76 |
4.89 |
-9.38 |
-0.86 |
0 |
|
|
155654 |
56366658 |
1 |
Cl2O2N5H17C20 |
A2B2C5D17E20 |
19.96 |
5.87 |
-9.04 |
-1.33 |
0 |
|
|
155655 |
56366660 |
1 |
FSO2N6H15C20 |
ABC2D6E15F20 |
21.19 |
7.35 |
-9.06 |
-1.43 |
0 |
|
|
155656 |
56366661 |
1 |
O3N6C23H24 |
A3B6C23D24 |
-21.06 |
7.43 |
-9.0 |
-1.25 |
0 |
|
|
155657 |
56366672 |
4 |
NOH5C6 |
ABC5D6 |
-72.28 |
3.94 |
-9.26 |
-2.06 |
0 |
|
|
155658 |
56366681 |
1 |
NSO5H21C24 |
ABC5D21E24 |
-117.67 |
3.26 |
-8.68 |
-0.66 |
0 |
|
|
155659 |
56366710 |
1 |
BrO3N4H19C24 |
AB3C4D19E24 |
32.35 |
4.46 |
-9.75 |
-1.5 |
0 |
|
|
155660 |
56366711 |
1 |
BrO2F3N3H13C16 |
AB2C3D3E13F16 |
-195.66 |
8.4 |
-9.36 |
-1.27 |
0 |
|
|
155661 |
56366712 |
1 |
BrFO2N3H17C19 |
ABC2D3E17F19 |
-88.96 |
7.57 |
-8.79 |
-0.63 |
0 |
|
|
155662 |
56366714 |
1 |
BrO2N3H14C18 |
AB2C3D14E18 |
-10.08 |
3.53 |
-8.95 |
-1.4 |
0 |
|
|
155663 |
56366729 |
1 |
ClNSF2O5H16C18 |
ABCD2E5F16G18 |
-258.1 |
3.52 |
-9.19 |
-1.02 |
0 |
|
|
155664 |
56366744 |
1 |
N2S2O4C21H22 |
A2B2C4D21E22 |
-73.0 |
9.23 |
-8.7 |
-0.99 |
0 |
|
|
155665 |
56366759 |
1 |
SN3O4C20H27 |
AB3C4D20E27 |
-135.78 |
5.87 |
-9.3 |
-0.83 |
0 |
|
|
155666 |
56366777 |
1 |
N3O4C21H31 |
A3B4C21D31 |
-202.52 |
2.25 |
-9.08 |
-0.32 |
0 |
|
|
155667 |
56366779 |
1 |
SO2N5C22H31 |
AB2C5D22E31 |
-58.66 |
5.67 |
-8.82 |
-0.48 |
0 |
|
|
155668 |
56366780 |
1 |
SN3O5C22H33 |
AB3C5D22E33 |
-220.37 |
9.53 |
-9.56 |
-0.85 |
0 |
|
|
155669 |
56366785 |
2 |
N2O2C11H13 |
A2B2C11D13 |
-123.19 |
4.47 |
-8.91 |
-0.46 |
0 |
|
|
155670 |
56366788 |
1 |
FSO2N6H15C20 |
ABC2D6E15F20 |
21.09 |
8.28 |
-9.03 |
-1.52 |
0 |
|
|
155671 |
56366799 |
1 |
N4O5C21H22 |
A4B5C21D22 |
-95.81 |
5.74 |
-8.96 |
-0.6 |
0 |
|
|
155672 |
56366800 |
1 |
SN4O4C22H26 |
AB4C4D22E26 |
-101.63 |
7.72 |
-9.14 |
-1.43 |
0 |
|
|
155673 |
56366808 |
1 |
SN3O5C24H25 |
AB3C5D24E25 |
-164.35 |
3.38 |
-8.54 |
-0.44 |
0 |
|
|
155674 |
56366831 |
1 |
FO2N5H24C26 |
AB2C5D24E26 |
-17.54 |
4.31 |
-9.16 |
-1.08 |
0 |
|
|
155675 |
56366846 |
1 |
BrSN3O3C17H18 |
ABC3D3E17F18 |
-91.46 |
7.57 |
-8.83 |
-1.06 |
0 |
|
|
155676 |
56366847 |
1 |
BrN2O3C17H17 |
AB2C3D17E17 |
-80.96 |
7.9 |
-8.82 |
-0.72 |
0 |
|
|
155677 |
56366855 |
1 |
ClSF2N3O3H14C18 |
ABC2D3E3F14G18 |
-163.63 |
3.39 |
-9.27 |
-1.0 |
0 |
|
|
155678 |
56366860 |
1 |
BrClSF2N2O3H12C17 |
ABCD2E2F3G12H17 |
-173.0 |
1.5 |
-9.19 |
-1.16 |
0 |
|
|
155679 |
56366871 |
1 |
ClSN2O4C21H25 |
ABC2D4E21F25 |
-134.83 |
5.91 |
-9.2 |
-1.05 |
0 |
|
|
155680 |
56366875 |
1 |
SN3O3C28H31 |
AB3C3D28E31 |
-63.07 |
9.48 |
-8.64 |
-0.66 |
0 |
|
|
155681 |
56366880 |
1 |
SN3O4C23H25 |
AB3C4D23E25 |
-62.0 |
4.29 |
-9.38 |
-0.93 |
0 |
|
|
155682 |
56366882 |
1 |
SO3N4C20H28 |
AB3C4D20E28 |
-94.09 |
4.87 |
-8.9 |
-0.69 |
0 |
|
|
155683 |
56366888 |
1 |
S2N3O4C21H27 |
A2B3C4D21E27 |
-134.25 |
5.07 |
-9.26 |
-0.64 |
0 |
|
|
155684 |
56366889 |
1 |
ClSN2O3C23H27 |
ABC2D3E23F27 |
-95.75 |
3.07 |
-9.48 |
-0.67 |
0 |
|
|
155685 |
56366896 |
1 |
N3S3O4C18H27 |
A3B3C4D18E27 |
-162.74 |
4.05 |
-8.69 |
-1.4 |
0 |
|
|
155686 |
56366897 |
1 |
N2O3C23H28 |
A2B3C23D28 |
-93.9 |
3.87 |
-8.81 |
-0.06 |
0 |
|
|
155687 |
56366900 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-48.54 |
6.12 |
-9.0 |
-0.6 |
0 |
|
|
155688 |
56366909 |
1 |
SN4O5C18H24 |
AB4C5D18E24 |
-132.95 |
4.1 |
-9.31 |
-1.82 |
0 |