List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
12246 |
133471 |
2 |
O3C10H15 |
A3B10C15 |
-263.24 |
5.17 |
-9.36 |
-0.71 |
0 |
|
|
12247 |
133472 |
1 |
NO7C13H13 |
AB7C13D13 |
-287.27 |
6.04 |
-9.39 |
-1.21 |
0 |
|
|
12248 |
133478 |
2 |
NH8C10 |
AB8C10 |
91.36 |
2.32 |
-8.4 |
-0.42 |
0 |
|
|
12249 |
133488 |
1 |
BN3O5C13H20 |
AB3C5D13E20 |
-192.11 |
4.8 |
-9.44 |
-1.59 |
0 |
|
|
12250 |
133495 |
1 |
OC28H44 |
AB28C44 |
-80.39 |
2.3 |
-9.15 |
1.16 |
0 |
|
|
12251 |
133496 |
1 |
INPO4C12H19 |
ABCD4E12F19 |
-148.0 |
12.34 |
-6.76 |
-1.26 |
0 |
|
|
12252 |
133513 |
1 |
SN5O10C28H37 |
AB5C10D28E37 |
-405.34 |
9.79 |
-9.71 |
-1.46 |
0 |
|
|
12253 |
133522 |
1 |
O4N5C8H11 |
A4B5C8D11 |
-122.32 |
7.62 |
-9.1 |
-0.64 |
0 |
|
|
12254 |
133576 |
1 |
NSO3C16H23 |
ABC3D16E23 |
-139.47 |
7.25 |
-9.14 |
-0.11 |
0 |
|
|
12255 |
133578 |
1 |
SN10O12C43H66 |
AB10C12D43E66 |
-555.31 |
13.53 |
-9.41 |
-1.17 |
0 |
|
|
12256 |
133614 |
1 |
ClSN2O2C9H11 |
ABC2D2E9F11 |
-59.81 |
5.06 |
-9.38 |
-0.73 |
0 |
|
|
12257 |
133615 |
1 |
ClN3O4C23H34 |
AB3C4D23E34 |
-180.04 |
5.34 |
-9.67 |
-0.42 |
0 |
|
|
12258 |
133629 |
1 |
BrO2C12H13 |
AB2C12D13 |
-62.06 |
2.79 |
-9.33 |
-0.28 |
0 |
|
|
12259 |
133633 |
1 |
ClON2C20H21 |
ABC2D20E21 |
-0.04 |
4.79 |
-8.63 |
-0.2 |
0 |
|
|
12260 |
133634 |
1 |
NCl2C9H17 |
AB2C9D17 |
-46.75 |
2.71 |
-9.12 |
0.66 |
0 |
|
|
12261 |
133639 |
1 |
SN2O3C10H10 |
AB2C3D10E10 |
-101.5 |
2.99 |
-9.73 |
-0.94 |
0 |
|
|
12262 |
133642 |
1 |
NO2C20H21 |
AB2C20D21 |
-33.1 |
1.7 |
-8.64 |
-0.43 |
0 |
|
|
12263 |
133671 |
5 |
OC5H8 |
AB5C8 |
-272.65 |
4.91 |
-9.86 |
0.19 |
0 |
|
|
12264 |
133680 |
2 |
ON2C7H12 |
AB2C7D12 |
-62.06 |
3.07 |
-9.18 |
-0.5 |
0 |
|
|
12265 |
133697 |
1 |
O4C27H44 |
A4B27C44 |
-224.08 |
2.17 |
-9.13 |
0.53 |
0 |
|
|
12266 |
133830 |
1 |
NO2C10H11 |
AB2C10D11 |
-43.23 |
5.1 |
-9.59 |
0.12 |
0 |
|
|
12267 |
133841 |
1 |
SN4O5C10H18 |
AB4C5D10E18 |
-224.29 |
6.52 |
-9.35 |
-0.46 |
0 |
|
|
12268 |
133894 |
2 |
O2C11H17 |
A2B11C17 |
-166.67 |
2.46 |
-9.48 |
-1.84 |
0 |
|
|
12269 |
133917 |
1 |
NPSO7C43H86 |
ABCD7E43F86 |
-535.32 |
13.44 |
-8.34 |
-0.33 |
0 |
|
|
12270 |
133923 |
2 |
N2O3C12H12 |
A2B3C12D12 |
-168.44 |
8.37 |
-9.0 |
-0.9 |
0 |
|
|
12271 |
133927 |
1 |
S2N8O9C27H28 |
A2B8C9D27E28 |
-271.51 |
4.26 |
-9.3 |
-1.52 |
0 |
|
|
12272 |
133963 |
1 |
OCl2N3H17C18 |
AB2C3D17E18 |
-0.52 |
2.21 |
-9.13 |
-1.2 |
0 |
|
|
12273 |
133980 |
1 |
CuCl2N6O8C12H16 |
AB2C6D8E12F16 |
156.17 |
15.29 |
0.0 |
0.0 |
0 |
|
|
12274 |
134005 |
1 |
N3O5C10H15 |
A3B5C10D15 |
-198.45 |
4.25 |
-9.78 |
-0.62 |
0 |
|
|
12275 |
134006 |
1 |
OS2N3H9C12 |
AB2C3D9E12 |
66.0 |
7.79 |
-9.02 |
-0.99 |
0 |
|
|
12276 |
134033 |
1 |
ClON6C13H13 |
ABC6D13E13 |
74.35 |
1.92 |
-9.92 |
-0.73 |
0 |
|
|
12277 |
134042 |
1 |
SN3O4H13C15 |
AB3C4D13E15 |
-73.59 |
4.47 |
-8.42 |
-0.75 |
0 |
|
|
12278 |
134096 |
1 |
PSN3O7H14C15 |
ABC3D7E14F15 |
-278.67 |
3.01 |
-9.57 |
-1.77 |
0 |
|
|
12279 |
134112 |
1 |
FON2C22H27 |
ABC2D22E27 |
-49.08 |
1.93 |
-8.36 |
-0.09 |
0 |
|
|
12280 |
134116 |
1 |
O8H16C17 |
A8B16C17 |
-270.84 |
3.22 |
-8.92 |
-0.98 |
0 |
|
|
12281 |
134122 |
1 |
NO5H15C19 |
AB5C15D19 |
-114.18 |
2.48 |
-8.87 |
-1.25 |
0 |
|
|
12282 |
134133 |
1 |
O4N10C21H22 |
A4B10C21D22 |
-11.61 |
5.68 |
-8.79 |
-1.16 |
0 |
|
|
12283 |
134135 |
2 |
NO3C5H7 |
AB3C5D7 |
-237.91 |
7.98 |
-10.05 |
-0.45 |
0 |
|
|
12284 |
134136 |
1 |
ClNO5C22H24 |
ABC5D22E24 |
-150.63 |
4.64 |
-8.75 |
-0.43 |
0 |
|
|
12285 |
134139 |
1 |
SO5C19H32 |
AB5C19D32 |
-258.99 |
6.66 |
-9.27 |
-0.06 |
0 |
|
|
12286 |
134177 |
1 |
N3I4O7H15C20 |
A3B4C7D15E20 |
-123.76 |
6.74 |
-8.98 |
-1.56 |
0 |
|
|
12287 |
134197 |
1 |
S2O9H10C13 |
A2B9C10D13 |
-325.72 |
5.64 |
-9.44 |
-1.92 |
0 |
|
|
12288 |
134198 |
1 |
BrNO2C12H16 |
ABC2D12E16 |
-71.76 |
2.63 |
-9.12 |
-0.06 |
0 |
|
|
12289 |
134200 |
1 |
PN6O7C10H15 |
AB6C7D10E15 |
-265.1 |
8.45 |
-9.8 |
-1.36 |
0 |
|
|
12290 |
134206 |
6 |
OC4H5 |
AB4C5 |
-239.77 |
3.59 |
-9.16 |
-0.41 |
0 |
|
|
12291 |
134219 |
1 |
BrPN2O8C11H12 |
ABC2D8E11F12 |
-370.46 |
5.34 |
-9.67 |
-1.41 |
-2 |
|
|
12292 |
134227 |
1 |
ClNOSC14H14 |
ABCDE14F14 |
-11.36 |
6.19 |
-9.38 |
-0.6 |
0 |
|
|
12293 |
134229 |
1 |
BrON2C8H9 |
ABC2D8E9 |
-15.66 |
4.53 |
-10.11 |
-0.78 |
0 |
|
|
12294 |
134247 |
1 |
NO6C19H33 |
AB6C19D33 |
-314.65 |
4.34 |
-9.72 |
0.65 |
0 |
|
|
12295 |
134266 |
2 |
N2C7H9 |
A2B7C9 |
34.06 |
1.64 |
-8.83 |
0.16 |
0 |
|
|
12296 |
134269 |
1 |
NaSO9H13C15 |
ABC9D13E15 |
-395.49 |
9.79 |
-8.49 |
-0.61 |
0 |
|
|
12297 |
134274 |
1 |
NO2H27C30 |
AB2C27D30 |
24.91 |
3.42 |
-8.32 |
-0.69 |
0 |
|
|
12298 |
134305 |
1 |
O2S2N3C18H21 |
A2B2C3D18E21 |
-47.15 |
2.07 |
-8.79 |
-1.1 |
0 |
|
|
12299 |
134307 |
1 |
ON3S3C18H20 |
AB3C3D18E20 |
43.45 |
3.76 |
0.0 |
0.0 |
1 |
|
|
12300 |
134333 |
1 |
NO4C20H23 |
AB4C20D23 |
-106.31 |
1.6 |
-8.31 |
0.24 |
0 |
|
|
12301 |
134362 |
1 |
ClN4O5C9H15 |
AB4C5D9E15 |
-195.09 |
7.83 |
-9.23 |
-0.94 |
0 |
|
|
12302 |
134368 |
2 |
NO3C14H17 |
AB3C14D17 |
-218.86 |
7.34 |
-9.54 |
-1.23 |
0 |
|
|
12303 |
134370 |
1 |
N2O3C27H28 |
A2B3C27D28 |
-65.74 |
9.1 |
-9.14 |
-0.66 |
0 |
|
|
12304 |
134391 |
1 |
ON2C9H11 |
AB2C9D11 |
50.76 |
1.5 |
0.0 |
0.0 |
1 |
|
|
12306 |
134454 |
1 |
N3O4H15C18 |
A3B4C15D18 |
-88.55 |
9.06 |
-9.23 |
-1.07 |
0 |
|
|
12307 |
134492 |
2 |
O3H5C8 |
A3B5C8 |
-150.12 |
9.34 |
-8.59 |
-1.46 |
0 |
|
|
12308 |
134522 |
2 |
SO5H7C8 |
AB5C7D8 |
-339.82 |
1.05 |
-10.34 |
-1.82 |
0 |
|
|
12309 |
134561 |
3 |
OH4C5 |
AB4C5 |
-61.0 |
1.58 |
-9.11 |
-0.81 |
0 |
|
|
12310 |
134575 |
1 |
IN2O2C9H13 |
AB2C2D9E13 |
-39.27 |
4.63 |
-8.1 |
-0.17 |
0 |
|
|
12311 |
134635 |
1 |
NO3C4H7 |
AB3C4D7 |
-106.43 |
5.11 |
-10.25 |
-0.35 |
0 |
|
|
12312 |
134646 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-74.59 |
3.88 |
-8.9 |
-0.57 |
0 |
|
|
12313 |
134700 |
1 |
ON3C15H15 |
AB3C15D15 |
40.5 |
4.53 |
-8.26 |
-1.15 |
0 |
|
|
12314 |
134701 |
1 |
ON3C6H11 |
AB3C6D11 |
-22.74 |
2.87 |
-8.74 |
0.57 |
0 |
|
|
12315 |
134703 |
1 |
O4C27H42 |
A4B27C42 |
-206.77 |
3.09 |
-8.86 |
0.02 |
0 |
|
|
12316 |
134706 |
1 |
O3N4C10H10 |
A3B4C10D10 |
-42.92 |
10.29 |
-9.29 |
-1.5 |
0 |
|
|
12317 |
134707 |
3 |
OC5H8 |
AB5C8 |
-166.87 |
3.63 |
-10.18 |
0.26 |
0 |
|
|
12319 |
134750 |
1 |
Cl2O4C9H18 |
A2B4C9D18 |
-217.86 |
2.22 |
-10.21 |
0.37 |
0 |
|
|
12320 |
134754 |
1 |
O7C22H26 |
A7B22C26 |
-308.85 |
8.66 |
-9.27 |
-0.52 |
0 |
|
|
12321 |
134852 |
4 |
NOH2C3 |
ABC2D3 |
-92.99 |
5.38 |
-9.94 |
-2.6 |
0 |
|
|
12322 |
134853 |
1 |
OC27H44 |
AB27C44 |
-90.42 |
2.5 |
-9.08 |
1.53 |
0 |