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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
37453 |
8021265 |
1 |
FSN2O4H17C20 |
ABC2D4E17F20 |
-125.03 |
2.6 |
-8.52 |
-1.52 |
0 |
|
|
37454 |
8021287 |
1 |
FSN2O4C21H21 |
ABC2D4E21F21 |
-180.28 |
2.61 |
-8.56 |
-1.12 |
0 |
|
|
37455 |
8021295 |
1 |
FNSO5C15H16 |
ABCD5E15F16 |
-226.61 |
6.86 |
-10.22 |
-1.38 |
0 |
|
|
37456 |
8021305 |
1 |
ClNF2O3H14C18 |
ABC2D3E14F18 |
-171.8 |
3.64 |
-9.1 |
-1.38 |
0 |
|
|
37457 |
8021306 |
1 |
ClNF2O3H14C18 |
ABC2D3E14F18 |
-171.06 |
4.15 |
-9.2 |
-1.32 |
0 |
|
|
37458 |
8021315 |
1 |
FNO3C17H20 |
ABC3D17E20 |
-159.84 |
2.44 |
-9.81 |
-1.2 |
0 |
|
|
37459 |
8021324 |
1 |
FNO3C22H26 |
ABC3D22E26 |
-171.37 |
4.43 |
-9.72 |
-0.86 |
0 |
|
|
37460 |
8021326 |
1 |
FNO4H18C19 |
ABC4D18E19 |
-158.59 |
4.08 |
-8.73 |
-1.43 |
0 |
|
|
37461 |
8021368 |
1 |
BrFNO3H15C18 |
ABCD3E15F18 |
-114.59 |
5.53 |
-9.12 |
-1.42 |
0 |
|
|
37462 |
8021372 |
1 |
FNO3C20H20 |
ABC3D20E20 |
-129.44 |
3.92 |
-8.64 |
-1.26 |
0 |
|
|
37463 |
8021376 |
1 |
BrNF2O3H12C17 |
ABC2D3E12F17 |
-150.53 |
4.84 |
-9.18 |
-1.48 |
0 |
|
|
37464 |
8021384 |
1 |
ClFNO3H17C19 |
ABCD3E17F19 |
-118.92 |
6.62 |
-9.47 |
-1.32 |
0 |
|
|
37465 |
8021385 |
1 |
FNO3C19H24 |
ABC3D19E24 |
-171.4 |
5.02 |
-9.71 |
-1.31 |
0 |
|
|
37466 |
8021386 |
1 |
FNO3C19H24 |
ABC3D19E24 |
-170.39 |
4.8 |
-9.68 |
-1.28 |
0 |
|
|
37467 |
8021388 |
1 |
FNO3H18C19 |
ABC3D18E19 |
-128.59 |
4.93 |
-8.59 |
-1.39 |
0 |
|
|
37468 |
8021390 |
1 |
FNO4C16H18 |
ABC4D16E18 |
-187.65 |
2.73 |
-9.51 |
-1.19 |
0 |
|
|
37469 |
8021425 |
1 |
FN2O3H13C18 |
AB2C3D13E18 |
-34.92 |
2.48 |
-9.61 |
-1.32 |
0 |
|
|
37470 |
8021441 |
1 |
ClN2O3C18H19 |
AB2C3D18E19 |
-106.75 |
5.24 |
-8.62 |
-0.62 |
0 |
|
|
37471 |
8021443 |
1 |
ClNO4H14C15 |
ABC4D14E15 |
-137.9 |
3.55 |
-8.94 |
-0.91 |
0 |
|
|
37472 |
8021458 |
1 |
ClN2O2H17C18 |
AB2C2D17E18 |
-8.1 |
2.58 |
-8.85 |
-0.83 |
0 |
|
|
37473 |
8021461 |
1 |
ClNO3H16C19 |
ABC3D16E19 |
-65.57 |
4.18 |
-8.82 |
-0.95 |
0 |
|
|
37474 |
8021464 |
1 |
ClNO2H18C20 |
ABC2D18E20 |
-34.21 |
2.86 |
-8.89 |
-0.87 |
0 |
|
|
37475 |
8021472 |
1 |
ClN2O3C17H19 |
AB2C3D17E19 |
-114.75 |
1.46 |
-8.87 |
-0.83 |
0 |
|
|
37476 |
8021480 |
1 |
ClFN2O4H12C18 |
ABC2D4E12F18 |
-68.8 |
5.62 |
-9.03 |
-1.66 |
0 |
|
|
37477 |
8021482 |
1 |
ClFO2H12C18 |
ABC2D12E18 |
-55.64 |
5.13 |
-8.56 |
-1.01 |
0 |
|
|
37478 |
8021484 |
1 |
Cl2N2O5H14C17 |
A2B2C5D14E17 |
-150.95 |
2.02 |
-8.52 |
-1.88 |
0 |
|
|
37479 |
8021495 |
1 |
Cl2N3O4C17H19 |
A2B3C4D17E19 |
-152.51 |
7.04 |
-9.53 |
-1.53 |
0 |
|
|
37480 |
8021498 |
1 |
Cl2N3O4H9C10 |
A2B3C4D9E10 |
-122.18 |
1.6 |
-9.41 |
-1.72 |
0 |
|
|
37481 |
8021506 |
1 |
Cl2N2O5H12C16 |
A2B2C5D12E16 |
-147.95 |
1.64 |
-8.48 |
-1.89 |
0 |
|
|
37482 |
8021509 |
1 |
Cl2N3O4H13C16 |
A2B3C4D13E16 |
-125.66 |
2.31 |
-8.81 |
-1.84 |
0 |
|
|
37483 |
8021511 |
1 |
FCl2N2O3H11C15 |
AB2C2D3E11F15 |
-131.17 |
2.6 |
-8.99 |
-1.95 |
0 |
|
|
37484 |
8021513 |
1 |
Cl2N2O3H16C18 |
A2B2C3D16E18 |
-87.56 |
4.67 |
-9.34 |
-1.6 |
0 |
|
|
37485 |
8021522 |
1 |
NCl2O5H13C16 |
AB2C5D13E16 |
-140.33 |
4.17 |
-8.82 |
-1.59 |
0 |
|
|
37486 |
8021523 |
1 |
Cl2N2O3H16C21 |
A2B2C3D16E21 |
-53.41 |
3.3 |
-8.78 |
-1.65 |
0 |
|
|
37487 |
8021526 |
1 |
Cl2N2O4H8C13 |
A2B2C4D8E13 |
-39.12 |
3.25 |
-10.22 |
-1.75 |
0 |
|
|
37488 |
8021528 |
1 |
Cl2N2O3H14C20 |
A2B2C3D14E20 |
-48.79 |
4.26 |
-8.99 |
-1.68 |
0 |
|
|
37489 |
8021530 |
1 |
Cl2N3O3H9C11 |
A2B3C3D9E11 |
-72.5 |
5.4 |
-10.2 |
-1.73 |
0 |
|
|
37490 |
8021542 |
1 |
NCl3O3H8C14 |
AB3C3D8E14 |
-71.4 |
4.7 |
-10.06 |
-1.55 |
0 |
|
|
37491 |
8021553 |
1 |
NCl2O3H13C16 |
AB2C3D13E16 |
-82.91 |
4.65 |
-9.4 |
-1.51 |
0 |
|
|
37492 |
8021567 |
1 |
Cl2N2O3C18H18 |
A2B2C3D18E18 |
-94.88 |
2.82 |
-9.58 |
-1.72 |
0 |
|
|
37493 |
8021572 |
1 |
NCl2O3H17C18 |
AB2C3D17E18 |
-98.0 |
5.51 |
-9.2 |
-1.48 |
0 |
|
|
37494 |
8021576 |
1 |
Cl2N2O5H10C15 |
A2B2C5D10E15 |
-77.29 |
3.26 |
-10.14 |
-1.68 |
0 |
|
|
37495 |
8021580 |
1 |
Cl2N3O3H11C12 |
A2B3C3D11E12 |
-72.06 |
6.1 |
-10.12 |
-1.62 |
0 |
|
|
37496 |
8021581 |
1 |
Cl2N3O4C14H15 |
A2B3C4D14E15 |
-144.1 |
6.41 |
-9.52 |
-1.6 |
0 |
|
|
37497 |
8021594 |
1 |
Cl2N2O3C15H18 |
A2B2C3D15E18 |
-129.1 |
1.27 |
-9.87 |
-1.82 |
0 |
|
|
37498 |
8021618 |
1 |
Cl2N2O5H14C17 |
A2B2C5D14E17 |
-154.25 |
3.24 |
-8.56 |
-1.79 |
0 |
|
|
37499 |
8021641 |
1 |
Cl2N3O4C11H11 |
A2B3C4D11E11 |
-151.81 |
6.74 |
-10.05 |
-1.53 |
0 |
|
|
37500 |
8021648 |
2 |
ClNO2H6C7 |
ABC2D6E7 |
-114.82 |
2.75 |
-9.62 |
-1.78 |
0 |
|
|
37501 |
8021653 |
1 |
NCl2O4H13C18 |
AB2C4D13E18 |
-115.37 |
6.31 |
-9.48 |
-1.74 |
0 |
|
|
37502 |
8021656 |
1 |
Cl2N2O3H14C16 |
A2B2C3D14E16 |
-77.37 |
5.54 |
-9.65 |
-1.44 |
0 |
|
|
37503 |
8021659 |
1 |
Cl2N3O4H9C10 |
A2B3C4D9E10 |
-147.95 |
4.51 |
-10.14 |
-1.58 |
0 |
|
|
37504 |
8021662 |
1 |
Cl2N2O3C17H20 |
A2B2C3D17E20 |
-117.07 |
0.74 |
-9.25 |
-1.73 |
0 |
|
|
37505 |
8021666 |
1 |
Cl2N3O4C16H19 |
A2B3C4D16E19 |
-174.3 |
2.24 |
-10.02 |
-1.66 |
0 |
|
|
37506 |
8021669 |
1 |
Cl2N2O3H8C9 |
A2B2C3D8E9 |
-108.81 |
1.5 |
-10.27 |
-1.82 |
0 |
|
|
37507 |
8021674 |
1 |
Cl2N3O4C12H13 |
A2B3C4D12E13 |
-159.54 |
1.46 |
-10.1 |
-1.91 |
0 |
|
|
37508 |
8021677 |
1 |
Cl2N3O4C12H13 |
A2B3C4D12E13 |
-164.18 |
3.27 |
-10.29 |
-1.87 |
0 |
|
|
37509 |
8021678 |
1 |
SCl2N3O4H11C15 |
AB2C3D4E11F15 |
-97.9 |
4.24 |
-9.42 |
-1.54 |
0 |
|
|
37510 |
8021694 |
1 |
Cl2N2O3C19H20 |
A2B2C3D19E20 |
-105.58 |
1.66 |
-9.14 |
-1.82 |
0 |
|
|
37511 |
8021701 |
1 |
Cl2N3O3H11C16 |
A2B3C3D11E16 |
-51.59 |
6.48 |
-9.42 |
-1.98 |
0 |
|
|
37512 |
8021709 |
1 |
FCl2N2O3H15C17 |
AB2C2D3E15F17 |
-138.05 |
2.96 |
-9.6 |
-1.88 |
0 |
|
|
37513 |
8021730 |
1 |
FNCl2O3H10C15 |
ABC2D3E10F15 |
-117.33 |
4.47 |
-10.11 |
-1.6 |
0 |
|
|
37514 |
8021737 |
1 |
Cl2N2O3H14C18 |
A2B2C3D14E18 |
-69.33 |
7.35 |
-9.04 |
-1.34 |
0 |
|
|
37515 |
8021749 |
1 |
NCl2O4H15C16 |
AB2C4D15E16 |
-121.51 |
4.33 |
-8.38 |
-1.45 |
0 |
|
|
37516 |
8021754 |
1 |
Cl2N2O3H16C17 |
A2B2C3D16E17 |
-84.91 |
5.19 |
-9.79 |
-1.49 |
0 |
|
|
37517 |
8021793 |
1 |
Cl2N2O5H14C17 |
A2B2C5D14E17 |
-161.11 |
3.59 |
-10.22 |
-1.91 |
0 |
|
|
37518 |
8021817 |
2 |
ClNO2H8C9 |
ABC2D8E9 |
-124.46 |
1.37 |
-9.53 |
-1.94 |
0 |
|
|
37519 |
8021818 |
2 |
ClNO2H8C9 |
ABC2D8E9 |
-124.28 |
2.99 |
-9.7 |
-1.76 |
0 |
|
|
37520 |
8021831 |
2 |
ClNO2H7C8 |
ABC2D7E8 |
-117.84 |
5.02 |
-9.05 |
-1.78 |
0 |
|
|
37521 |
8021832 |
1 |
Cl2N3O4C14H15 |
A2B3C4D14E15 |
-152.16 |
6.43 |
-9.72 |
-1.38 |
0 |
|
|
37522 |
8021842 |
1 |
Cl2N3O4H15C18 |
A2B3C4D15E18 |
-101.74 |
3.08 |
-9.34 |
-1.62 |
0 |
|
|
37523 |
8021843 |
1 |
NCl2O4H15C17 |
AB2C4D15E17 |
-119.36 |
6.87 |
-9.4 |
-1.43 |
0 |
|
|
37524 |
8021850 |
1 |
BrOSN5C12H14 |
ABCD5E12F14 |
52.65 |
3.84 |
-9.54 |
-0.9 |
0 |
|
|
37525 |
8021854 |
1 |
SO2N6C15H20 |
AB2C6D15E20 |
-1.84 |
4.49 |
-8.55 |
-1.11 |
0 |
|
|
37526 |
8021865 |
1 |
OSN5C18H21 |
ABC5D18E21 |
67.56 |
7.29 |
-8.79 |
-0.4 |
0 |
|
|
37527 |
8021869 |
1 |
SO2N6H8C9 |
AB2C6D8E9 |
94.01 |
4.43 |
-9.66 |
-1.48 |
0 |