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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
78052 |
49681605 |
1 |
S2N3O5C21H23 |
A2B3C5D21E23 |
-146.45 |
4.43 |
-9.12 |
-1.54 |
0 |
|
|
78053 |
49681606 |
1 |
S2N3O5C22H25 |
A2B3C5D22E25 |
-146.4 |
5.41 |
-9.22 |
-1.53 |
0 |
|
|
78054 |
49681607 |
1 |
S2N3O4C21H25 |
A2B3C4D21E25 |
-97.33 |
9.18 |
-8.74 |
-1.1 |
0 |
|
|
78055 |
49681611 |
1 |
S2N3O3C21H25 |
A2B3C3D21E25 |
-72.87 |
6.76 |
-8.85 |
-1.07 |
0 |
|
|
78056 |
49681612 |
1 |
S2N3O5C21H25 |
A2B3C5D21E25 |
-129.55 |
10.08 |
-8.84 |
-1.1 |
0 |
|
|
78057 |
49681613 |
1 |
S2N3O3C21H25 |
A2B3C3D21E25 |
-82.53 |
7.09 |
-8.65 |
-1.19 |
0 |
|
|
78058 |
49681614 |
1 |
S2N3O5C22H27 |
A2B3C5D22E27 |
-145.56 |
9.24 |
-8.26 |
-1.1 |
0 |
|
|
78059 |
49681617 |
1 |
S2N3O4C23H29 |
A2B3C4D23E29 |
-125.68 |
6.36 |
-8.68 |
-1.23 |
0 |
|
|
78060 |
49681618 |
1 |
S2N3O5C23H27 |
A2B3C5D23E27 |
-114.71 |
11.87 |
-8.63 |
-1.08 |
0 |
|
|
78061 |
49681621 |
1 |
S2N3O4C21H25 |
A2B3C4D21E25 |
-98.14 |
8.37 |
-9.06 |
-1.34 |
0 |
|
|
78062 |
49681622 |
1 |
ClS2N3O4C21H24 |
AB2C3D4E21F24 |
-115.36 |
5.97 |
-9.05 |
-1.47 |
0 |
|
|
78063 |
49681623 |
1 |
FS2N3O4C21H24 |
AB2C3D4E21F24 |
-152.49 |
6.15 |
-9.1 |
-1.48 |
0 |
|
|
78064 |
49681624 |
1 |
S2N4O6C21H24 |
A2B4C6D21E24 |
-110.48 |
6.27 |
-9.42 |
-1.87 |
0 |
|
|
78065 |
49681625 |
1 |
S2N3O5C22H27 |
A2B3C5D22E27 |
-145.14 |
4.74 |
-8.66 |
-1.1 |
0 |
|
|
78066 |
49681626 |
1 |
S2N3O5C23H29 |
A2B3C5D23E29 |
-148.13 |
7.6 |
-8.7 |
-1.25 |
0 |
|
|
78067 |
49681627 |
1 |
S2N3O4C23H29 |
A2B3C4D23E29 |
-116.87 |
7.1 |
-8.9 |
-1.21 |
0 |
|
|
78068 |
49681628 |
1 |
S2N3O4C22H27 |
A2B3C4D22E27 |
-112.29 |
6.22 |
-8.94 |
-1.37 |
0 |
|
|
78069 |
49681629 |
1 |
ClS2N3O4C22H26 |
AB2C3D4E22F26 |
-114.02 |
6.09 |
-9.13 |
-1.51 |
0 |
|
|
78070 |
49681630 |
1 |
FS2N3O4C22H26 |
AB2C3D4E22F26 |
-153.23 |
5.03 |
-9.16 |
-1.37 |
0 |
|
|
78071 |
49681632 |
1 |
FS2N3O4C21H24 |
AB2C3D4E21F24 |
-143.7 |
4.08 |
-9.16 |
-1.38 |
0 |
|
|
78072 |
49681633 |
1 |
FS2N3O4C22H26 |
AB2C3D4E22F26 |
-155.33 |
4.45 |
-9.11 |
-1.44 |
0 |
|
|
78073 |
49681634 |
1 |
F2S2N3O4C21H23 |
A2B2C3D4E21F23 |
-195.49 |
3.64 |
-9.33 |
-1.57 |
0 |
|
|
78074 |
49681636 |
1 |
S2N3O5C22H25 |
A2B3C5D22E25 |
-144.64 |
7.87 |
-8.92 |
-1.08 |
0 |
|
|
78075 |
49681637 |
1 |
S2N3O5C21H23 |
A2B3C5D21E23 |
-136.07 |
7.85 |
-9.06 |
-1.2 |
0 |
|
|
78076 |
49681638 |
1 |
ClS2N3O5C21H22 |
AB2C3D5E21F22 |
-152.25 |
5.61 |
-9.1 |
-1.53 |
0 |
|
|
78077 |
49681639 |
1 |
FS2N3O5C21H22 |
AB2C3D5E21F22 |
-189.27 |
3.72 |
-9.15 |
-1.52 |
0 |
|
|
78078 |
49681640 |
1 |
S2N3O6C22H25 |
A2B3C6D22E25 |
-180.41 |
8.41 |
-8.72 |
-1.4 |
0 |
|
|
78079 |
49681641 |
1 |
FS2N3O5C21H22 |
AB2C3D5E21F22 |
-178.94 |
6.68 |
-9.23 |
-1.37 |
0 |
|
|
78080 |
49681642 |
1 |
F2S2N3O5C21H21 |
A2B2C3D5E21F21 |
-234.33 |
2.57 |
-9.33 |
-1.57 |
0 |
|
|
78081 |
49681644 |
1 |
S2N3O5C22H25 |
A2B3C5D22E25 |
-150.34 |
5.9 |
-8.93 |
-1.38 |
0 |
|
|
78082 |
49681646 |
1 |
FS2N3O5C22H24 |
AB2C3D5E22F24 |
-194.2 |
4.63 |
-9.18 |
-1.49 |
0 |
|
|
78083 |
49681647 |
1 |
S2N3O5C23H25 |
A2B3C5D23E25 |
-130.0 |
3.53 |
-9.12 |
-1.54 |
0 |
|
|
78084 |
49681648 |
1 |
S2N3O3C21H23 |
A2B3C3D21E23 |
-40.71 |
7.4 |
-8.95 |
-1.17 |
0 |
|
|
78085 |
49681649 |
1 |
FS2N3O3C21H22 |
AB2C3D3E21F22 |
-92.14 |
6.93 |
-9.07 |
-1.45 |
0 |
|
|
78086 |
49681650 |
1 |
S2N4O5C21H22 |
A2B4C5D21E22 |
-50.02 |
3.61 |
-9.39 |
-1.8 |
0 |
|
|
78087 |
49681651 |
1 |
S2N3O4C22H25 |
A2B3C4D22E25 |
-83.07 |
9.19 |
-8.67 |
-1.31 |
0 |
|
|
78088 |
49681652 |
1 |
FS2N3O3C21H22 |
AB2C3D3E21F22 |
-82.02 |
7.34 |
-9.14 |
-1.19 |
0 |
|
|
78089 |
49681653 |
1 |
S2N3O3C22H23 |
A2B3C3D22E23 |
-7.41 |
8.09 |
-8.91 |
-1.26 |
0 |
|
|
78090 |
49681654 |
1 |
S2N3O5C24H25 |
A2B3C5D24E25 |
-90.47 |
5.28 |
-9.24 |
-1.5 |
0 |
|
|
78091 |
49681655 |
1 |
S2N3O5C23H23 |
A2B3C5D23E23 |
-87.09 |
7.64 |
-9.12 |
-1.54 |
0 |
|
|
78092 |
49681656 |
1 |
S2N3O3C21H21 |
A2B3C3D21E21 |
1.68 |
7.79 |
-9.01 |
-1.22 |
0 |
|
|
78093 |
49681657 |
1 |
ClS2N3O3H20C21 |
AB2C3D3E20F21 |
-12.52 |
5.87 |
-9.05 |
-1.46 |
0 |
|
|
78094 |
49681658 |
1 |
FS2N3O3H20C21 |
AB2C3D3E20F21 |
-44.5 |
5.58 |
-9.14 |
-1.47 |
0 |
|
|
78095 |
49681659 |
1 |
S2N4O5H20C21 |
A2B4C5D20E21 |
-8.25 |
4.36 |
-9.41 |
-1.84 |
0 |
|
|
78096 |
49681660 |
1 |
S2N3O4C22H23 |
A2B3C4D22E23 |
-40.47 |
9.42 |
-8.68 |
-1.32 |
0 |
|
|
78097 |
49681662 |
1 |
FS2N3O3H20C21 |
AB2C3D3E20F21 |
-35.01 |
6.79 |
-9.2 |
-1.39 |
0 |
|
|
78098 |
49681663 |
1 |
F2S2N3O3H19C21 |
A2B2C3D3E19F21 |
-91.62 |
4.79 |
-9.3 |
-1.52 |
0 |
|
|
78099 |
49681664 |
1 |
S2N3O3C21H25 |
A2B3C3D21E25 |
-66.69 |
8.97 |
-8.9 |
-1.18 |
0 |
|
|
78100 |
49681666 |
1 |
S2N3O5C21H23 |
A2B3C5D21E23 |
-133.27 |
5.93 |
-8.59 |
-1.34 |
0 |
|
|
78101 |
49681667 |
1 |
BrS2N3O3C19H20 |
AB2C3D3E19F20 |
-52.9 |
7.37 |
-9.1 |
-1.48 |
0 |
|
|
78102 |
49681668 |
1 |
S2N3O5C21H23 |
A2B3C5D21E23 |
-135.62 |
9.0 |
-8.53 |
-1.25 |
0 |
|
|
78103 |
49681669 |
1 |
S2N3O5C22H25 |
A2B3C5D22E25 |
-136.17 |
8.63 |
-8.59 |
-1.19 |
0 |
|
|
78104 |
49681672 |
1 |
S2N3O3C21H25 |
A2B3C3D21E25 |
-69.94 |
9.67 |
-8.84 |
-1.16 |
0 |
|
|
78105 |
49681674 |
1 |
S2N3O5C23H25 |
A2B3C5D23E25 |
-118.92 |
8.29 |
-8.52 |
-1.27 |
0 |
|
|
78106 |
49681675 |
1 |
S2N3O5C23H23 |
A2B3C5D23E23 |
-76.58 |
6.92 |
-8.53 |
-1.29 |
0 |
|
|
78107 |
49681676 |
1 |
S2N3O5C22H23 |
A2B3C5D22E23 |
-97.14 |
9.31 |
-8.72 |
-1.32 |
0 |
|
|
78108 |
49681677 |
1 |
S2N3O5H21C22 |
A2B3C5D21E22 |
-61.3 |
7.98 |
-8.74 |
-1.28 |
0 |
|
|
78109 |
49681678 |
1 |
S2N3O5C21H25 |
A2B3C5D21E25 |
-131.85 |
9.77 |
-8.45 |
-1.11 |
0 |
|
|
78110 |
49681679 |
1 |
S2N3O5C23H27 |
A2B3C5D23E27 |
-116.3 |
8.7 |
-8.43 |
-1.1 |
0 |
|
|
78111 |
49681680 |
1 |
S2N3O5C23H25 |
A2B3C5D23E25 |
-71.91 |
8.33 |
-8.41 |
-1.09 |
0 |
|
|
78112 |
49681681 |
1 |
S2N3O3C21H25 |
A2B3C3D21E25 |
-80.23 |
8.31 |
-8.64 |
-1.21 |
0 |
|
|
78113 |
49681682 |
1 |
S2N3O5C23H27 |
A2B3C5D23E27 |
-157.44 |
5.73 |
-8.7 |
-1.29 |
0 |
|
|
78114 |
49681683 |
1 |
S2N3O4C23H29 |
A2B3C4D23E29 |
-123.73 |
6.69 |
-8.68 |
-1.25 |
0 |
|
|
78115 |
49681684 |
1 |
S2N3O4C24H31 |
A2B3C4D24E31 |
-122.86 |
8.43 |
-8.63 |
-0.98 |
0 |
|
|
78116 |
49681685 |
1 |
S2N3O5C22H27 |
A2B3C5D22E27 |
-145.53 |
6.47 |
-8.27 |
-1.21 |
0 |
|
|
78117 |
49681686 |
1 |
N3O3S3C20H23 |
A3B3C3D20E23 |
-60.35 |
7.66 |
-8.66 |
-1.42 |
0 |
|
|
78118 |
49681687 |
1 |
N3S3O4C22H27 |
A3B3C4D22E27 |
-105.94 |
5.69 |
-8.78 |
-1.44 |
0 |
|
|
78119 |
49681688 |
1 |
N3O3S3C22H23 |
A3B3C3D22E23 |
-1.3 |
8.76 |
-8.51 |
-1.42 |
0 |
|
|
78120 |
49681689 |
1 |
N3O3S3C21H25 |
A3B3C3D21E25 |
-56.3 |
10.81 |
-8.95 |
-1.27 |
0 |
|
|
78121 |
49681692 |
1 |
N3S3O4C22H27 |
A3B3C4D22E27 |
-104.58 |
7.77 |
-8.66 |
-1.26 |
0 |
|
|
78122 |
49681694 |
1 |
SO2N3C15H23 |
AB2C3D15E23 |
-71.39 |
2.0 |
-8.83 |
-0.11 |
0 |
|
|
78123 |
49681695 |
1 |
SO2N3C16H23 |
AB2C3D16E23 |
-46.51 |
2.0 |
-8.85 |
-0.1 |
0 |
|
|
78124 |
49681696 |
1 |
SO2N3C16H23 |
AB2C3D16E23 |
-42.19 |
0.72 |
-8.81 |
-0.27 |
0 |
|
|
78125 |
49681697 |
1 |
SO2N3C16H25 |
AB2C3D16E25 |
-76.27 |
2.14 |
-8.86 |
-0.08 |
0 |
|
|
78126 |
49681698 |
1 |
SO2N3C16H25 |
AB2C3D16E25 |
-79.96 |
2.28 |
-8.8 |
-0.07 |
0 |
|
|
78127 |
49681699 |
1 |
SO2N3C17H27 |
AB2C3D17E27 |
-88.2 |
2.4 |
-8.76 |
0.0 |
0 |
|
|
78128 |
49681700 |
1 |
SO2N3C17H27 |
AB2C3D17E27 |
-81.86 |
1.99 |
-8.76 |
-0.07 |
0 |
|
|
78129 |
49681701 |
1 |
SN3O3C16H25 |
AB3C3D16E25 |
-106.89 |
2.43 |
-8.86 |
-0.12 |
0 |
|
|
78130 |
49681702 |
1 |
SO2N3C18H27 |
AB2C3D18E27 |
-75.81 |
1.92 |
-8.86 |
-0.06 |
0 |
|
|
78131 |
49681703 |
1 |
SO2N3C19H23 |
AB2C3D19E23 |
-32.17 |
0.76 |
-8.9 |
-0.59 |
0 |
|
|
78132 |
49681704 |
1 |
SN3O3C18H23 |
AB3C3D18E23 |
-66.54 |
1.65 |
-8.73 |
-0.29 |
0 |
|
|
78133 |
49681705 |
1 |
SO3N4C17H22 |
AB3C4D17E22 |
-40.13 |
2.85 |
-8.83 |
-0.63 |
0 |
|
|
78134 |
49681707 |
1 |
SO2N3C20H25 |
AB2C3D20E25 |
-33.97 |
1.03 |
-8.74 |
-0.18 |
0 |
|
|
78135 |
49681708 |
1 |
SO2N3C20H25 |
AB2C3D20E25 |
-45.16 |
2.23 |
-8.82 |
-0.48 |
0 |
|
|
78136 |
49681709 |
1 |
SO2N3C20H25 |
AB2C3D20E25 |
-46.59 |
0.73 |
-8.86 |
-0.54 |
0 |
|
|
78137 |
49681711 |
1 |
FSO2N3C19H22 |
ABC2D3E19F22 |
-77.25 |
1.94 |
-8.77 |
-0.78 |
0 |
|
|
78138 |
49681713 |
1 |
FSO2N3C19H22 |
ABC2D3E19F22 |
-81.03 |
2.87 |
-8.78 |
-0.81 |
0 |
|
|
78139 |
49681714 |
1 |
O2S2N3C18H23 |
A2B2C3D18E23 |
-29.4 |
1.94 |
-8.87 |
-0.51 |
0 |
|
|
78140 |
49681716 |
1 |
SO2N3C21H27 |
AB2C3D21E27 |
-48.56 |
2.51 |
-8.83 |
-0.1 |
0 |
|
|
78141 |
49681717 |
1 |
SO2N3C21H27 |
AB2C3D21E27 |
-57.21 |
1.37 |
-8.86 |
-0.49 |
0 |
|
|
78142 |
49681718 |
1 |
SO2N3C21H27 |
AB2C3D21E27 |
-48.67 |
0.91 |
-8.85 |
-0.52 |
0 |
|
|
78143 |
49681719 |
1 |
SO2N3C21H27 |
AB2C3D21E27 |
-48.98 |
1.57 |
-8.85 |
-0.48 |
0 |
|
|
78144 |
49681720 |
1 |
SO2N3C21H27 |
AB2C3D21E27 |
-40.84 |
1.34 |
-8.87 |
-0.14 |
0 |
|
|
78145 |
49681721 |
1 |
SO2N3C21H27 |
AB2C3D21E27 |
-46.92 |
0.37 |
-8.85 |
-0.3 |
0 |
|
|
78146 |
49681723 |
1 |
SO2N3C21H27 |
AB2C3D21E27 |
-54.76 |
0.93 |
-8.76 |
-0.47 |
0 |
|
|
78147 |
49681725 |
1 |
SO2N3C21H27 |
AB2C3D21E27 |
-54.17 |
2.23 |
-8.79 |
-0.5 |
0 |
|
|
78148 |
49681726 |
1 |
SN3O3C20H25 |
AB3C3D20E25 |
-75.47 |
0.41 |
-8.55 |
-0.5 |
0 |
|
|
78149 |
49681727 |
1 |
SN3O3C20H25 |
AB3C3D20E25 |
-78.06 |
2.69 |
-8.82 |
-0.62 |
0 |
|
|
78150 |
49681729 |
1 |
SO2N3C21H31 |
AB2C3D21E31 |
-72.6 |
2.44 |
-8.86 |
-0.11 |
0 |
|
|
78151 |
49681730 |
1 |
ClSO2N3C19H22 |
ABC2D3E19F22 |
-42.26 |
2.31 |
-8.87 |
-0.84 |
0 |