List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
374193 |
131325305 |
1 |
ON2C13H20 |
AB2C13D20 |
-24.11 |
4.2 |
-8.44 |
0.36 |
0 |
|
|
374194 |
131325307 |
2 |
ON2C5H7 |
AB2C5D7 |
-52.18 |
0.73 |
-9.34 |
-1.16 |
0 |
|
|
374195 |
131325318 |
1 |
BrNOC12H18 |
ABCD12E18 |
-45.53 |
3.17 |
-8.73 |
0.09 |
0 |
|
|
374196 |
131325323 |
1 |
NO2C12H13 |
AB2C12D13 |
-48.36 |
2.61 |
-10.45 |
-1.31 |
0 |
|
|
374197 |
131325324 |
1 |
NO2C12H13 |
AB2C12D13 |
-46.35 |
7.54 |
-10.36 |
-1.16 |
0 |
|
|
374198 |
131325326 |
1 |
NO3C11H11 |
AB3C11D11 |
-79.25 |
8.99 |
-9.73 |
-1.29 |
0 |
|
|
374199 |
131325327 |
1 |
ClFN2H6C11 |
ABC2D6E11 |
22.8 |
3.92 |
-9.7 |
-1.4 |
0 |
|
|
374200 |
131325350 |
1 |
SO2H12C13 |
AB2C12D13 |
-24.68 |
5.15 |
-8.67 |
-0.81 |
0 |
|
|
374201 |
131325357 |
1 |
OSN2C12H12 |
ABC2D12E12 |
31.23 |
4.32 |
-8.7 |
-0.67 |
0 |
|
|
374202 |
131325365 |
1 |
SO2H12C13 |
AB2C12D13 |
-44.44 |
5.24 |
-9.52 |
-0.85 |
0 |
|
|
374203 |
131325409 |
1 |
BrNO3H6C10 |
ABC3D6E10 |
-35.09 |
1.45 |
-10.27 |
-1.91 |
0 |
|
|
374204 |
131325440 |
1 |
NOC6H13 |
ABC6D13 |
-44.53 |
2.61 |
-8.91 |
2.54 |
0 |
|
|
374205 |
131325448 |
1 |
IN2O3H7C9 |
AB2C3D7E9 |
-60.94 |
3.4 |
-9.73 |
-1.6 |
0 |
|
|
374206 |
131325468 |
1 |
NO3C8H15 |
AB3C8D15 |
-140.67 |
3.03 |
-9.64 |
0.76 |
0 |
|
|
374207 |
131325469 |
1 |
NO3C8H15 |
AB3C8D15 |
-147.76 |
3.18 |
-9.2 |
0.55 |
0 |
|
|
374208 |
131325498 |
1 |
OBr2N2C8H10 |
AB2C2D8E10 |
-10.19 |
1.4 |
-9.89 |
-0.92 |
0 |
|
|
374209 |
131325499 |
1 |
OBr2N2C10H14 |
AB2C2D10E14 |
-33.4 |
0.36 |
-9.48 |
-1.1 |
0 |
|
|
374210 |
131325500 |
1 |
SN3C9H9 |
AB3C9D9 |
81.0 |
1.04 |
-9.42 |
-1.25 |
0 |
|
|
374211 |
131325508 |
1 |
BrClN2C10H14 |
ABC2D10E14 |
-4.49 |
1.03 |
-9.77 |
-0.96 |
0 |
|
|
374212 |
131325516 |
1 |
INSH4O4C9 |
ABCD4E4F9 |
-22.83 |
0.56 |
-9.8 |
-2.47 |
0 |
|
|
374213 |
131325518 |
1 |
INSH4O4C9 |
ABCD4E4F9 |
-24.05 |
6.47 |
-9.72 |
-2.27 |
0 |
|
|
374214 |
131325521 |
1 |
BrOSN4H7C9 |
ABCD4E7F9 |
39.56 |
5.18 |
-8.99 |
-1.99 |
0 |
|
|
374215 |
131325547 |
1 |
FNO2H8C11 |
ABC2D8E11 |
-39.63 |
2.21 |
-10.12 |
-0.74 |
0 |
|
|
374216 |
131325548 |
1 |
ClFNOH9C11 |
ABCDE9F11 |
-24.21 |
1.9 |
-9.99 |
-0.57 |
0 |
|
|
374217 |
131325557 |
1 |
BrNO2F3H7C9 |
ABC2D3E7F9 |
-151.18 |
2.32 |
-10.48 |
-2.07 |
0 |
|
|
374218 |
131325567 |
1 |
BrNO2F3H7C9 |
ABC2D3E7F9 |
-153.69 |
7.85 |
-10.56 |
-1.58 |
0 |
|
|
374219 |
131325568 |
1 |
BrNO2F3H7C9 |
ABC2D3E7F9 |
-146.28 |
7.74 |
-10.56 |
-1.79 |
0 |
|
|
374220 |
131325572 |
1 |
BrNO2F3H7C9 |
ABC2D3E7F9 |
-152.48 |
5.27 |
-10.63 |
-2.02 |
0 |
|
|
374221 |
131325574 |
1 |
NF3O3H8C9 |
AB3C3D8E9 |
-190.99 |
5.98 |
-10.64 |
-1.72 |
0 |
|
|
374222 |
131325591 |
1 |
BrINC10H11 |
ABCD10E11 |
28.51 |
2.98 |
-9.44 |
-1.1 |
0 |
|
|
374223 |
131325598 |
1 |
IN2C10H13 |
AB2C10D13 |
22.95 |
1.62 |
-8.6 |
-0.71 |
0 |
|
|
374224 |
131325600 |
1 |
BrON2C11H13 |
ABC2D11E13 |
-33.22 |
4.17 |
-9.52 |
-0.62 |
0 |
|
|
374225 |
131325604 |
1 |
IN2C10H13 |
AB2C10D13 |
21.13 |
1.92 |
-8.42 |
-0.69 |
0 |
|
|
374226 |
131325614 |
1 |
INO2C12H14 |
ABC2D12E14 |
-58.75 |
2.41 |
-9.39 |
-1.1 |
0 |
|
|
374227 |
131325618 |
1 |
IN2C10H13 |
AB2C10D13 |
21.14 |
2.47 |
-8.42 |
-0.68 |
0 |
|
|
374228 |
131325626 |
1 |
ON3C12H17 |
AB3C12D17 |
-24.44 |
4.26 |
-9.26 |
-0.36 |
0 |
|
|
374229 |
131325632 |
1 |
INSO2H6C11 |
ABCD2E6F11 |
3.14 |
2.86 |
-9.4 |
-1.69 |
0 |
|
|
374230 |
131325649 |
1 |
BrClNSH7C11 |
ABCDE7F11 |
61.57 |
1.74 |
-9.17 |
-1.21 |
0 |
|
|
374231 |
131325667 |
1 |
N2O2S2C9H10 |
A2B2C2D9E10 |
-31.3 |
5.9 |
-9.45 |
-0.77 |
0 |
|
|
374232 |
131325671 |
1 |
SN2O3C10H14 |
AB2C3D10E14 |
-84.48 |
5.06 |
-8.24 |
-0.89 |
0 |
|
|
374233 |
131325683 |
1 |
NO2C10H13 |
AB2C10D13 |
-67.66 |
6.61 |
-9.24 |
-1.33 |
0 |
|
|
374234 |
131325688 |
2 |
NOC6H8 |
ABC6D8 |
-43.88 |
5.5 |
-8.96 |
-0.81 |
0 |
|
|
374235 |
131325693 |
1 |
ClNOC10H10 |
ABCD10E10 |
7.09 |
2.37 |
-10.2 |
-1.19 |
0 |
|
|
374236 |
131325695 |
1 |
NO2C11H15 |
AB2C11D15 |
-57.51 |
2.49 |
-9.26 |
-0.5 |
0 |
|
|
374237 |
131325711 |
1 |
ClNSO3C10H14 |
ABCD3E10F14 |
-117.88 |
5.67 |
-9.87 |
-0.85 |
0 |
|
|
374238 |
131325725 |
1 |
NO2C13H15 |
AB2C13D15 |
-59.8 |
2.5 |
-8.8 |
-0.59 |
0 |
|
|
374239 |
131325732 |
1 |
BrO2C7H9 |
AB2C7D9 |
-62.81 |
3.87 |
-10.82 |
-0.27 |
0 |
|
|
374240 |
131325734 |
1 |
BrClSN4H8C9 |
ABCD4E8F9 |
72.32 |
3.78 |
-8.76 |
-0.72 |
0 |
|
|
374241 |
131325747 |
1 |
BrNO2S2H8C10 |
ABC2D2E8F10 |
34.62 |
3.67 |
-8.89 |
-1.82 |
0 |
|
|
374242 |
131325753 |
1 |
BrNO2S2H8C10 |
ABC2D2E8F10 |
35.29 |
4.81 |
-8.97 |
-1.78 |
0 |
|
|
374243 |
131325776 |
1 |
O2N4C9H10 |
A2B4C9D10 |
-26.17 |
4.18 |
-9.05 |
-0.98 |
0 |
|
|
374244 |
131325777 |
1 |
O2N4C9H10 |
A2B4C9D10 |
-10.32 |
4.92 |
-8.82 |
-0.97 |
0 |
|
|
374245 |
131325798 |
1 |
BrO3C8H9 |
AB3C8D9 |
-108.38 |
4.48 |
-9.03 |
-0.26 |
0 |
|
|
374246 |
131325801 |
1 |
BrO3C8H9 |
AB3C8D9 |
-110.56 |
1.75 |
-9.19 |
-0.34 |
0 |
|
|
374247 |
131325810 |
1 |
NSO3C6H13 |
ABC3D6E13 |
-117.7 |
4.4 |
-9.61 |
0.73 |
0 |
|
|
374248 |
131325817 |
1 |
ON4C10H14 |
AB4C10D14 |
26.14 |
4.97 |
-8.99 |
0.67 |
0 |
|
|
374249 |
131325828 |
1 |
ON4C11H20 |
AB4C11D20 |
-16.87 |
4.06 |
-8.87 |
0.72 |
0 |
|
|
374250 |
131325835 |
1 |
ClFO3C10H10 |
ABC3D10E10 |
-170.24 |
5.0 |
-9.54 |
-0.62 |
0 |
|
|
374251 |
131325852 |
2 |
BrNC6H8 |
ABC6D8 |
26.8 |
2.36 |
-8.8 |
-0.52 |
0 |
|
|
374252 |
131325858 |
1 |
N2O3C10H16 |
A2B3C10D16 |
-116.16 |
3.23 |
-9.97 |
-0.66 |
0 |
|
|
374253 |
131325860 |
1 |
NSBr2O2H5C9 |
ABC2D2E5F9 |
40.2 |
4.7 |
-9.43 |
-2.0 |
0 |
|
|
374254 |
131325865 |
1 |
NO4H9C10 |
AB4C9D10 |
-119.96 |
3.71 |
-9.8 |
-1.05 |
0 |
|
|
374255 |
131325871 |
1 |
BrClSO3H6C10 |
ABCD3E6F10 |
-88.16 |
4.92 |
-9.45 |
-1.52 |
0 |
|
|
374256 |
131325875 |
1 |
BrClSO3H6C10 |
ABCD3E6F10 |
-88.72 |
3.83 |
-9.47 |
-1.52 |
0 |
|
|
374257 |
131325894 |
1 |
N5H9C11 |
A5B9C11 |
105.09 |
3.58 |
-9.46 |
-1.47 |
0 |
|
|
374258 |
131325901 |
1 |
BrNO3C10H14 |
ABC3D10E14 |
-115.03 |
5.44 |
-8.73 |
-0.57 |
0 |
|
|
374259 |
131325908 |
1 |
NBr2F3H8C9 |
AB2C3D8E9 |
-144.12 |
3.17 |
-8.26 |
-0.51 |
0 |
|
|
374260 |
131325920 |
1 |
BrNOC13H16 |
ABCD13E16 |
-6.66 |
3.1 |
-8.99 |
-0.26 |
0 |
|
|
374261 |
131325947 |
1 |
ClN2F3O3H4C7 |
AB2C3D3E4F7 |
-256.84 |
5.12 |
-9.49 |
-1.83 |
0 |
|
|
374262 |
131325954 |
1 |
ClN2F3O3H4C7 |
AB2C3D3E4F7 |
-255.25 |
8.04 |
-9.78 |
-1.68 |
0 |
|
|
374263 |
131325965 |
1 |
FNO2C12H14 |
ABC2D12E14 |
-95.71 |
3.84 |
-9.35 |
-0.41 |
0 |
|
|
374264 |
131325969 |
1 |
NSO2F3H6C9 |
ABC2D3E6F9 |
-206.76 |
3.72 |
-8.43 |
-0.64 |
0 |
|
|
374265 |
131325978 |
1 |
NSO2F3H6C9 |
ABC2D3E6F9 |
-204.64 |
4.01 |
-8.73 |
-0.83 |
0 |
|
|
374266 |
131325982 |
1 |
N3C10H11 |
A3B10C11 |
47.3 |
3.14 |
-8.22 |
-0.35 |
0 |
|
|
374267 |
131325994 |
1 |
ClOS2C11H11 |
ABC2D11E11 |
-12.42 |
2.05 |
-8.31 |
-0.72 |
0 |
|
|
374268 |
131326004 |
1 |
NF2O4C9H9 |
AB2C4D9E9 |
-233.85 |
2.45 |
-9.59 |
-0.89 |
0 |
|
|
374269 |
131326012 |
1 |
SC4H4N4 |
AB4C4D4 |
97.36 |
6.8 |
-10.32 |
-1.63 |
0 |
|
|
374270 |
131326022 |
1 |
BrON2C9H9 |
ABC2D9E9 |
14.65 |
4.28 |
-9.59 |
-0.61 |
0 |
|
|
374271 |
131326031 |
1 |
ClN2O2H7C11 |
AB2C2D7E11 |
-17.67 |
1.97 |
-9.62 |
-1.45 |
0 |
|
|
374272 |
131326043 |
1 |
BrClOSH10C11 |
ABCDE10F11 |
-14.57 |
4.41 |
-8.47 |
-0.89 |
0 |
|
|
374273 |
131326044 |
1 |
BrClOSH10C11 |
ABCDE10F11 |
-18.09 |
4.91 |
-8.85 |
-0.68 |
0 |
|
|
374274 |
131326073 |
1 |
BrFO2N3H5C9 |
ABC2D3E5F9 |
14.58 |
6.75 |
-9.89 |
-1.79 |
0 |
|
|
374275 |
131326077 |
2 |
NO2C5H6 |
AB2C5D6 |
-52.93 |
3.37 |
-9.17 |
-1.83 |
0 |
|
|
374276 |
131326080 |
1 |
FOSN2C10H11 |
ABCD2E10F11 |
-54.01 |
2.92 |
-9.21 |
-0.85 |
0 |
|
|
374277 |
131326089 |
1 |
N3O3H9C10 |
A3B3C9D10 |
-53.81 |
7.33 |
-8.75 |
-1.52 |
0 |
|
|
374278 |
131326111 |
1 |
BrO3C11H11 |
AB3C11D11 |
-104.7 |
3.0 |
-10.42 |
-1.54 |
0 |
|
|
374279 |
131326123 |
1 |
BrO4C11H11 |
AB4C11D11 |
-158.66 |
3.73 |
-10.31 |
-1.25 |
0 |
|
|
374280 |
131326125 |
1 |
NOF2H9C11 |
ABC2D9E11 |
-88.83 |
1.28 |
-10.58 |
-1.56 |
0 |
|
|
374281 |
131326127 |
1 |
NOF2H9C11 |
ABC2D9E11 |
-87.48 |
5.29 |
-10.47 |
-1.57 |
0 |
|
|
374282 |
131326128 |
1 |
NOF2H9C11 |
ABC2D9E11 |
-84.8 |
0.85 |
-10.5 |
-1.64 |
0 |
|
|
374283 |
131326137 |
1 |
NOF2H9C11 |
ABC2D9E11 |
-87.71 |
2.1 |
-10.52 |
-1.41 |
0 |
|
|
374284 |
131326139 |
1 |
NOF2H9C11 |
ABC2D9E11 |
-86.85 |
2.09 |
-10.52 |
-1.57 |
0 |
|
|
374285 |
131326189 |
1 |
ON4C10H12 |
AB4C10D12 |
46.82 |
4.64 |
-8.57 |
-1.91 |
0 |
|
|
374286 |
131326199 |
1 |
BrN2O2F3H6C7 |
AB2C2D3E6F7 |
-217.11 |
2.27 |
-8.88 |
-1.07 |
0 |
|
|
374287 |
131326207 |
1 |
ON3C12H21 |
AB3C12D21 |
-24.63 |
2.51 |
-8.15 |
0.68 |
0 |
|
|
374288 |
131326219 |
1 |
O2N5C7H7 |
A2B5C7D7 |
22.74 |
6.81 |
-9.51 |
-1.63 |
0 |
|
|
374289 |
131326276 |
1 |
BrNSF2O2H6C8 |
ABCD2E2F6G8 |
-79.35 |
2.12 |
-9.34 |
-1.86 |
0 |
|
|
374290 |
131326280 |
1 |
SO2N4C8H10 |
AB2C4D8E10 |
-61.91 |
4.52 |
-8.31 |
-0.46 |
0 |
|
|
374291 |
131326288 |
1 |
O2N3C11H17 |
A2B3C11D17 |
-62.23 |
5.82 |
-9.38 |
0.08 |
0 |
|
|
374292 |
131326312 |
1 |
BrNSO2F3H5C7 |
ABCD2E3F5G7 |
-195.58 |
2.33 |
-10.43 |
-1.47 |
0 |