List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
371092 |
127342494 |
2 |
ON2C9H15 |
AB2C9D15 |
-69.79 |
8.43 |
-9.03 |
0.56 |
0 |
|
|
371093 |
127342495 |
1 |
O3N4C17H28 |
A3B4C17D28 |
-125.73 |
5.36 |
-9.49 |
0.43 |
0 |
|
|
371094 |
127342496 |
2 |
ON2C10H17 |
AB2C10D17 |
-74.83 |
4.62 |
-8.46 |
0.28 |
0 |
|
|
371095 |
127342497 |
1 |
O3N6C17H26 |
A3B6C17D26 |
-31.74 |
5.96 |
-9.42 |
-0.43 |
0 |
|
|
371096 |
127342498 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-118.77 |
7.23 |
-9.26 |
0.86 |
0 |
|
|
371097 |
127342499 |
1 |
O3N6C15H22 |
A3B6C15D22 |
-90.47 |
5.0 |
-8.72 |
0.08 |
0 |
|
|
371098 |
127342500 |
1 |
SN3O4C13H23 |
AB3C4D13E23 |
-191.62 |
4.35 |
-9.63 |
0.38 |
0 |
|
|
371099 |
127342501 |
1 |
O3N5C20H35 |
A3B5C20D35 |
-157.32 |
6.32 |
-9.05 |
0.73 |
0 |
|
|
371100 |
127342502 |
1 |
SO2N3C12H21 |
AB2C3D12E21 |
-98.1 |
4.86 |
-8.89 |
0.35 |
0 |
|
|
371101 |
127342503 |
1 |
O2N5C17H25 |
A2B5C17D25 |
-59.17 |
4.56 |
-9.14 |
-0.36 |
0 |
|
|
371102 |
127342504 |
1 |
O2N3C17H29 |
A2B3C17D29 |
-126.66 |
3.38 |
-9.32 |
1.11 |
0 |
|
|
371103 |
127342505 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-121.7 |
6.5 |
-9.31 |
0.82 |
0 |
|
|
371104 |
127342506 |
1 |
O3N4C17H32 |
A3B4C17D32 |
-165.12 |
0.6 |
-8.9 |
0.84 |
0 |
|
|
371105 |
127342507 |
1 |
SN3O4C12H21 |
AB3C4D12E21 |
-185.15 |
4.39 |
-9.57 |
0.36 |
0 |
|
|
371106 |
127342508 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-113.84 |
2.76 |
-9.34 |
1.03 |
0 |
|
|
371107 |
127342509 |
1 |
SO2N3C15H19 |
AB2C3D15E19 |
-70.99 |
5.52 |
-8.72 |
-0.38 |
0 |
|
|
371108 |
127342510 |
1 |
N3O3C13H23 |
A3B3C13D23 |
-151.01 |
1.31 |
-9.43 |
0.78 |
0 |
|
|
371109 |
127342511 |
1 |
O2N5C15H29 |
A2B5C15D29 |
-106.88 |
3.15 |
-8.39 |
1.04 |
0 |
|
|
371110 |
127342512 |
1 |
SO3N5C15H19 |
AB3C5D15E19 |
-86.32 |
3.54 |
-8.84 |
-0.88 |
0 |
|
|
371111 |
127342513 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-119.29 |
2.75 |
-9.28 |
1.0 |
0 |
|
|
371112 |
127342514 |
1 |
FN3O4C17H22 |
AB3C4D17E22 |
-204.87 |
5.18 |
-9.27 |
-0.57 |
0 |
|
|
371113 |
127342515 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-118.12 |
7.16 |
-9.23 |
0.87 |
0 |
|
|
371114 |
127342516 |
1 |
O2N3C22H25 |
A2B3C22D25 |
-45.88 |
6.53 |
-9.27 |
-0.02 |
0 |
|
|
371115 |
127342545 |
1 |
O3N4C19H32 |
A3B4C19D32 |
-162.87 |
4.24 |
-9.35 |
0.5 |
0 |
|
|
371116 |
127342546 |
1 |
ClO3N4C19H27 |
AB3C4D19E27 |
-119.73 |
5.5 |
-9.07 |
-0.34 |
0 |
|
|
371117 |
127342547 |
1 |
O2N3C17H27 |
A2B3C17D27 |
-104.78 |
7.45 |
-9.2 |
0.85 |
0 |
|
|
371118 |
127342548 |
1 |
N3O3C14H25 |
A3B3C14D25 |
-150.09 |
6.04 |
-9.29 |
0.73 |
0 |
|
|
371119 |
127342549 |
2 |
ON2C8H14 |
AB2C8D14 |
-107.78 |
8.26 |
-9.08 |
0.88 |
0 |
|
|
371120 |
127342550 |
1 |
O3N5C20H35 |
A3B5C20D35 |
-167.38 |
2.25 |
-9.12 |
0.71 |
0 |
|
|
371121 |
127342551 |
1 |
SO2N3C12H21 |
AB2C3D12E21 |
-107.2 |
1.15 |
-8.85 |
0.44 |
0 |
|
|
371122 |
127342566 |
1 |
SN3O4C14H25 |
AB3C4D14E25 |
-197.9 |
7.25 |
-9.77 |
0.33 |
0 |
|
|
371123 |
127342567 |
1 |
SN3O4C13H23 |
AB3C4D13E23 |
-191.7 |
6.33 |
-9.81 |
0.33 |
0 |
|
|
371124 |
127342568 |
1 |
SN3O4C12H21 |
AB3C4D12E21 |
-187.53 |
8.6 |
-9.81 |
0.22 |
0 |
|
|
371125 |
127342569 |
1 |
SO2N3C13H23 |
AB2C3D13E23 |
-109.8 |
3.73 |
-8.69 |
0.54 |
0 |
|
|
371126 |
127342570 |
1 |
O3N6C16H26 |
A3B6C16D26 |
-76.65 |
4.29 |
-9.38 |
-0.43 |
0 |
|
|
371127 |
127342571 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-112.34 |
1.45 |
-9.34 |
0.61 |
0 |
|
|
371128 |
127342572 |
1 |
SO2N3C11H19 |
AB2C3D11E19 |
-91.79 |
3.05 |
-8.76 |
0.48 |
0 |
|
|
371129 |
127342573 |
1 |
O3N5C13H23 |
A3B5C13D23 |
-123.19 |
4.88 |
-9.02 |
0.42 |
0 |
|
|
371130 |
127342574 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-116.66 |
3.93 |
-9.26 |
0.71 |
0 |
|
|
371131 |
127342575 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-112.4 |
3.08 |
-9.52 |
0.72 |
0 |
|
|
371132 |
127342576 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-104.86 |
3.32 |
-9.32 |
0.67 |
0 |
|
|
371133 |
127342577 |
1 |
SO2N3C14H17 |
AB2C3D14E17 |
-61.7 |
3.32 |
-8.56 |
-0.22 |
0 |
|
|
371134 |
127342578 |
3 |
NOC4H7 |
ABC4D7 |
-141.15 |
3.47 |
-9.36 |
0.51 |
0 |
|
|
371135 |
127342579 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-109.51 |
2.82 |
-9.26 |
0.68 |
0 |
|
|
371136 |
127342580 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-108.06 |
1.71 |
-9.17 |
0.7 |
0 |
|
|
371137 |
127342581 |
1 |
O2N5C13H17 |
A2B5C13D17 |
-45.35 |
4.7 |
-9.68 |
-0.59 |
0 |
|
|
371138 |
127342582 |
1 |
O2N3C15H27 |
A2B3C15D27 |
-116.56 |
3.89 |
-9.17 |
0.82 |
0 |
|
|
371139 |
127342583 |
1 |
O3N4C18H32 |
A3B4C18D32 |
-153.01 |
2.55 |
-8.89 |
0.59 |
0 |
|
|
371140 |
127342584 |
1 |
SO2N3C13H17 |
AB2C3D13E17 |
-60.03 |
2.4 |
-9.06 |
-0.18 |
0 |
|
|
371141 |
127342585 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-94.26 |
3.16 |
-9.34 |
0.62 |
0 |
|
|
371142 |
127342586 |
1 |
SO2N5C16H25 |
AB2C5D16E25 |
-61.92 |
2.37 |
-8.81 |
-0.28 |
0 |
|
|
371143 |
127342587 |
1 |
O3N4C13H22 |
A3B4C13D22 |
-149.04 |
4.49 |
-9.45 |
0.59 |
0 |
|
|
371144 |
127342588 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-105.79 |
3.47 |
-9.31 |
0.64 |
0 |
|
|
371145 |
127342589 |
1 |
SO2N3C14H19 |
AB2C3D14E19 |
-67.25 |
2.59 |
-9.06 |
-0.14 |
0 |
|
|
371146 |
127342590 |
1 |
SO2N3C11H19 |
AB2C3D11E19 |
-94.4 |
3.7 |
-8.72 |
0.44 |
0 |
|
|
371147 |
127342591 |
1 |
O2F3N3C12H18 |
A2B3C3D12E18 |
-262.71 |
3.9 |
-9.68 |
0.39 |
0 |
|
|
371148 |
127342592 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-73.14 |
2.88 |
-9.36 |
0.25 |
0 |
|
|
371149 |
127342593 |
1 |
SO2N3C10H17 |
AB2C3D10E17 |
-89.7 |
3.55 |
-8.75 |
0.43 |
0 |
|
|
371150 |
127342653 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-71.47 |
5.48 |
-8.78 |
-0.27 |
0 |
|
|
371151 |
127342654 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-61.59 |
8.79 |
-9.2 |
-0.25 |
0 |
|
|
371152 |
127342657 |
1 |
SN3O4C19H29 |
AB3C4D19E29 |
-154.17 |
3.68 |
-8.86 |
0.01 |
0 |
|
|
371153 |
127342658 |
1 |
NO2C14H17 |
AB2C14D17 |
-36.14 |
6.47 |
-8.7 |
-0.31 |
0 |
|
|
371154 |
127342679 |
1 |
O2N3C23H35 |
A2B3C23D35 |
-96.2 |
3.73 |
-8.93 |
-0.06 |
0 |
|
|
371155 |
127342680 |
1 |
ON3C14H23 |
AB3C14D23 |
-31.72 |
6.03 |
-8.92 |
0.69 |
0 |
|
|
371156 |
127342681 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-122.29 |
4.49 |
-8.69 |
-0.47 |
0 |
|
|
371157 |
127342682 |
1 |
SO2N3C17H25 |
AB2C3D17E25 |
-65.85 |
2.76 |
-8.71 |
-0.72 |
0 |
|
|
371158 |
127342683 |
1 |
O2N3C22H31 |
A2B3C22D31 |
-84.48 |
4.67 |
-8.68 |
-0.42 |
0 |
|
|
371159 |
127342690 |
1 |
ON3C14H23 |
AB3C14D23 |
-32.22 |
2.71 |
-8.83 |
0.48 |
0 |
|
|
371160 |
127342691 |
1 |
ON4C15H24 |
AB4C15D24 |
-29.65 |
0.9 |
-8.79 |
-0.11 |
0 |
|
|
371161 |
127342692 |
1 |
FSN2O4C19H25 |
ABC2D4E19F25 |
-195.95 |
8.11 |
-9.23 |
-0.98 |
0 |
|
|
371162 |
127342698 |
1 |
N2O4C19H28 |
A2B4C19D28 |
-166.57 |
4.29 |
-8.61 |
-0.48 |
0 |
|
|
371163 |
127342699 |
1 |
N3O4C21H23 |
A3B4C21D23 |
-139.41 |
2.97 |
-8.79 |
-0.79 |
0 |
|
|
371164 |
127342704 |
1 |
N2O2C13H22 |
A2B2C13D22 |
-121.58 |
2.12 |
-9.36 |
0.64 |
0 |
|
|
371165 |
127342705 |
1 |
ON2C13H24 |
AB2C13D24 |
-68.84 |
3.3 |
-9.02 |
1.15 |
0 |
|
|
371166 |
127342706 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-114.53 |
3.09 |
-9.38 |
0.49 |
0 |
|
|
371167 |
127342707 |
1 |
SN2O3C13H24 |
AB2C3D13E24 |
-153.67 |
7.32 |
-9.36 |
0.37 |
0 |
|
|
371168 |
127343832 |
1 |
SO2N4C16H26 |
AB2C4D16E26 |
-71.37 |
2.09 |
-8.87 |
-0.84 |
0 |
|
|
371169 |
127343833 |
1 |
ON4C18H22 |
AB4C18D22 |
-0.24 |
2.04 |
-9.15 |
0.34 |
0 |
|
|
371170 |
127343834 |
1 |
ON4C22H30 |
AB4C22D30 |
-11.57 |
0.87 |
-9.08 |
0.34 |
0 |
|
|
371171 |
127343991 |
1 |
O2N5C16H25 |
A2B5C16D25 |
-79.84 |
2.62 |
-9.33 |
0.48 |
0 |
|
|
371172 |
127343992 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-119.21 |
4.67 |
-8.66 |
0.08 |
0 |
|
|
371173 |
127343993 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-119.31 |
4.15 |
-8.68 |
-0.09 |
0 |
|
|
371174 |
127343997 |
1 |
O3N4C20H28 |
A3B4C20D28 |
-90.93 |
3.09 |
-8.72 |
-0.37 |
0 |
|
|
371175 |
127343998 |
1 |
O2N4C19H32 |
A2B4C19D32 |
-81.56 |
2.51 |
-9.04 |
0.76 |
0 |
|
|
371176 |
127343999 |
2 |
ON2C9H15 |
AB2C9D15 |
-72.94 |
4.62 |
-9.34 |
0.71 |
0 |
|
|
371177 |
127344009 |
1 |
N3O3C17H25 |
A3B3C17D25 |
-97.66 |
2.96 |
-8.76 |
-0.34 |
0 |
|
|
371178 |
127344010 |
1 |
O2N3C20H31 |
A2B3C20D31 |
-85.17 |
4.22 |
-9.0 |
0.2 |
0 |
|
|
371179 |
127344011 |
1 |
ON5C23H33 |
AB5C23D33 |
-4.09 |
4.53 |
-9.02 |
0.16 |
0 |
|
|
371180 |
127344012 |
2 |
ON2C11H17 |
AB2C11D17 |
-104.34 |
5.11 |
-8.79 |
0.13 |
0 |
|
|
371181 |
127344013 |
1 |
ON5C17H29 |
AB5C17D29 |
-31.12 |
1.66 |
-8.46 |
0.53 |
0 |
|
|
371182 |
127344014 |
1 |
ON5C21H37 |
AB5C21D37 |
-44.05 |
2.36 |
-8.54 |
0.81 |
0 |
|
|
371183 |
127344015 |
1 |
ON5C20H35 |
AB5C20D35 |
-35.46 |
1.52 |
-8.44 |
0.64 |
0 |
|
|
371184 |
127344016 |
1 |
ON5C20H35 |
AB5C20D35 |
-38.33 |
6.09 |
-8.27 |
0.69 |
0 |
|
|
371185 |
127344017 |
1 |
ON5C20H35 |
AB5C20D35 |
-35.76 |
3.76 |
-8.51 |
0.78 |
0 |
|
|
371186 |
127344018 |
1 |
O2N5C19H27 |
A2B5C19D27 |
-42.22 |
2.22 |
-8.72 |
-0.42 |
0 |
|
|
371187 |
127344032 |
2 |
ON2C11H15 |
AB2C11D15 |
-45.25 |
4.95 |
-8.96 |
0.04 |
0 |
|
|
371188 |
127344033 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-47.17 |
7.2 |
-9.02 |
0.02 |
0 |
|
|
371189 |
127344034 |
1 |
O2N3C18H27 |
A2B3C18D27 |
-78.55 |
1.67 |
-8.92 |
0.36 |
0 |
|
|
371190 |
127344155 |
1 |
ON5C20H35 |
AB5C20D35 |
-45.27 |
3.28 |
-8.5 |
0.73 |
0 |
|
|
371191 |
127344156 |
1 |
FON4C16H17 |
ABC4D16E17 |
-11.82 |
7.03 |
-9.28 |
-0.02 |
0 |