List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
279175 |
103841842 |
1 |
BrClN2O2H8C11 |
ABC2D2E8F11 |
1.9 |
4.97 |
-9.56 |
-1.37 |
0 |
|
|
279176 |
103841862 |
1 |
BrClNO3C14H17 |
ABCD3E14F17 |
-125.92 |
3.44 |
-9.92 |
-1.02 |
0 |
|
|
279177 |
103841867 |
1 |
BrClNOF3C13H14 |
ABCDE3F13G14 |
-196.13 |
3.92 |
-9.94 |
-0.99 |
0 |
|
|
279178 |
103841875 |
1 |
BrClON2C14H18 |
ABCD2E14F18 |
-32.95 |
4.8 |
-8.92 |
-0.93 |
0 |
|
|
279179 |
103841879 |
1 |
BrClNOSC12H13 |
ABCDEF12G13 |
-32.36 |
2.54 |
-8.85 |
-0.99 |
0 |
|
|
279180 |
103841880 |
1 |
BrClNO3C15H19 |
ABCD3E15F19 |
-129.06 |
4.07 |
-9.75 |
-0.91 |
0 |
|
|
279181 |
103841887 |
1 |
BrClON2H10C11 |
ABCD2E10F11 |
7.17 |
4.35 |
-9.95 |
-1.0 |
0 |
|
|
279182 |
103841890 |
1 |
BrClNO3C15H17 |
ABCD3E15F17 |
-123.5 |
3.66 |
-9.73 |
-0.92 |
0 |
|
|
279183 |
103841906 |
1 |
BrClON2C15H18 |
ABCD2E15F18 |
-23.58 |
6.26 |
-9.24 |
-0.77 |
0 |
|
|
279184 |
103841917 |
1 |
BrClNOC13H15 |
ABCDE13F15 |
-37.44 |
4.73 |
-9.56 |
-0.76 |
0 |
|
|
279185 |
103841920 |
1 |
BrClON2H8C12 |
ABCD2E8F12 |
15.51 |
4.18 |
-9.78 |
-1.3 |
0 |
|
|
279186 |
103841929 |
1 |
BrClON3H11C12 |
ABCD3E11F12 |
10.0 |
4.95 |
-8.99 |
-1.02 |
0 |
|
|
279187 |
103841931 |
1 |
BrClNOC13H15 |
ABCDE13F15 |
-40.49 |
5.06 |
-9.58 |
-0.73 |
0 |
|
|
279188 |
103841933 |
1 |
BrClON3H11C13 |
ABCD3E11F13 |
32.91 |
3.28 |
-10.1 |
-1.16 |
0 |
|
|
279189 |
103841940 |
1 |
BrClNOF2H9C10 |
ABCDE2F9G10 |
-123.99 |
2.52 |
-9.98 |
-1.02 |
0 |
|
|
279190 |
103841945 |
1 |
BrClON2C12H12 |
ABCD2E12F12 |
-6.17 |
2.49 |
-9.92 |
-1.03 |
0 |
|
|
279191 |
103841948 |
1 |
BrClN2O2C12H12 |
ABC2D2E12F12 |
-67.54 |
7.93 |
-9.61 |
-0.58 |
0 |
|
|
279192 |
103841963 |
1 |
BrClN2O2C12H14 |
ABC2D2E12F14 |
-82.67 |
1.49 |
-9.98 |
-1.23 |
0 |
|
|
279193 |
103841965 |
1 |
BrCl2N2O2H9C14 |
AB2C2D2E9F14 |
-45.74 |
4.24 |
-9.61 |
-1.34 |
0 |
|
|
279194 |
103841979 |
1 |
BrClON3C14H19 |
ABCD3E14F19 |
-21.97 |
3.86 |
-8.54 |
-0.86 |
0 |
|
|
279195 |
103841991 |
1 |
BrClN2O2C13H14 |
ABC2D2E13F14 |
-69.9 |
5.1 |
-9.98 |
-1.03 |
0 |
|
|
279196 |
103841993 |
1 |
BrClNO3C13H15 |
ABCD3E13F15 |
-117.71 |
1.68 |
-9.88 |
-0.89 |
0 |
|
|
279197 |
103841997 |
1 |
BrClNO4C14H17 |
ABCD4E14F17 |
-154.04 |
4.69 |
-9.76 |
-0.8 |
0 |
|
|
279198 |
103841998 |
1 |
BrClNOSC13H15 |
ABCDEF13G15 |
-34.7 |
1.56 |
-8.68 |
-1.05 |
0 |
|
|
279199 |
103842004 |
1 |
BrClNOC12H13 |
ABCDE12F13 |
-20.44 |
4.01 |
-9.76 |
-0.86 |
0 |
|
|
279200 |
103842009 |
1 |
BrClON2C16H16 |
ABCD2E16F16 |
-0.38 |
3.39 |
-7.95 |
-1.06 |
0 |
|
|
279201 |
103842011 |
1 |
BrClON2C13H14 |
ABCD2E13F14 |
-7.61 |
2.42 |
-9.95 |
-0.98 |
0 |
|
|
279202 |
103842014 |
1 |
BrClNSO2C10H11 |
ABCDE2F10G11 |
-51.71 |
6.94 |
-8.9 |
-0.62 |
0 |
|
|
279203 |
103842018 |
1 |
BrClNOC12H13 |
ABCDE12F13 |
-19.17 |
4.51 |
-9.83 |
-0.9 |
0 |
|
|
279204 |
103842020 |
1 |
BrClON2C16H20 |
ABCD2E16F20 |
-32.18 |
4.59 |
-8.93 |
-0.81 |
0 |
|
|
279205 |
103842027 |
1 |
BrNOCl2H8C10 |
ABCD2E8F10 |
-16.69 |
2.77 |
-9.93 |
-1.03 |
0 |
|
|
279206 |
103842043 |
1 |
BrClON2H12C13 |
ABCD2E12F13 |
27.46 |
2.1 |
-9.94 |
-1.04 |
0 |
|
|
279207 |
103842046 |
1 |
BrClNSO3C12H13 |
ABCDE3F12G13 |
-110.89 |
2.64 |
-10.11 |
-1.16 |
0 |
|
|
279208 |
103842047 |
1 |
BrClNO2C15H19 |
ABCD2E15F19 |
-56.16 |
5.33 |
-9.58 |
-0.6 |
0 |
|
|
279209 |
103842062 |
1 |
BrClNO2C13H15 |
ABCD2E13F15 |
-77.39 |
3.58 |
-9.69 |
-0.97 |
0 |
|
|
279210 |
103842073 |
1 |
BrClNOSC11H11 |
ABCDEF11G11 |
-26.37 |
2.94 |
-8.79 |
-1.14 |
0 |
|
|
279211 |
103842074 |
1 |
ClNOC13H14 |
ABCD13E14 |
6.69 |
1.92 |
-9.51 |
-0.57 |
0 |
|
|
279212 |
103842078 |
1 |
BrClNO3C14H15 |
ABCD3E14F15 |
-117.29 |
5.42 |
-9.71 |
-0.81 |
0 |
|
|
279213 |
103842085 |
1 |
BrClNOH11C12 |
ABCDE11F12 |
8.69 |
3.81 |
-9.88 |
-0.95 |
0 |
|
|
279214 |
103842088 |
1 |
BrClNOSC12H15 |
ABCDEF12G15 |
-39.97 |
1.78 |
-8.72 |
-0.97 |
0 |
|
|
279215 |
103842094 |
1 |
N2O3C12H20 |
A2B3C12D20 |
-139.37 |
2.2 |
-9.35 |
0.36 |
0 |
|
|
279216 |
103842104 |
1 |
BrClNO3C14H17 |
ABCD3E14F17 |
-128.32 |
5.79 |
-9.75 |
-0.75 |
0 |
|
|
279217 |
103842109 |
1 |
BrClNO2H15C16 |
ABCD2E15F16 |
-44.89 |
5.23 |
-8.87 |
-0.97 |
0 |
|
|
279218 |
103842114 |
1 |
BrClNOSC15H15 |
ABCDEF15G15 |
-3.27 |
3.52 |
-9.15 |
-0.85 |
0 |
|
|
279219 |
103842140 |
1 |
BrClFNO2H10C14 |
ABCDE2F10G14 |
-79.24 |
3.17 |
-8.98 |
-1.1 |
0 |
|
|
279220 |
103842144 |
1 |
BrClNOC11H11 |
ABCDE11F11 |
-13.11 |
4.36 |
-9.86 |
-0.9 |
0 |
|
|
279221 |
103842145 |
1 |
BrClNO2C11H11 |
ABCD2E11F11 |
-67.0 |
4.97 |
-9.76 |
-0.78 |
0 |
|
|
279222 |
103842156 |
1 |
BrClFNOH10C14 |
ABCDEF10G14 |
-38.26 |
5.18 |
-9.28 |
-1.02 |
0 |
|
|
279223 |
103842160 |
1 |
BrClNO2C16H19 |
ABCD2E16F19 |
-90.09 |
5.58 |
-9.56 |
-0.79 |
0 |
|
|
279224 |
103842165 |
1 |
BrClN2O3H10C14 |
ABC2D3E10F14 |
-1.94 |
2.33 |
-10.06 |
-1.48 |
0 |
|
|
279225 |
103842171 |
1 |
BrClON2H12C15 |
ABCD2E12F15 |
10.95 |
2.73 |
-9.82 |
-0.92 |
0 |
|
|
279226 |
103842175 |
1 |
BrClON3H9C11 |
ABCD3E9F11 |
28.0 |
2.99 |
-9.39 |
-1.27 |
0 |
|
|
279227 |
103842178 |
1 |
NO2C10H21 |
AB2C10D21 |
-115.02 |
1.56 |
-8.86 |
1.98 |
0 |
|
|
279228 |
103842185 |
1 |
NOC11H23 |
ABC11D23 |
-86.48 |
3.37 |
-8.82 |
2.59 |
0 |
|
|
279229 |
103842193 |
1 |
BrFNOC14H15 |
ABCDE14F15 |
-64.01 |
2.78 |
-9.3 |
-0.96 |
0 |
|
|
279230 |
103842197 |
1 |
BrClFON2H7C12 |
ABCDE2F7G12 |
-22.32 |
4.73 |
-9.69 |
-1.04 |
0 |
|
|
279231 |
103842201 |
1 |
INOC14H16 |
ABCD14E16 |
-2.3 |
3.66 |
-9.52 |
-1.06 |
0 |
|
|
279232 |
103842203 |
1 |
ClNO2C12H14 |
ABC2D12E14 |
-53.88 |
3.02 |
-9.41 |
-0.58 |
0 |
|
|
279233 |
103842204 |
1 |
ON2C14H20 |
AB2C14D20 |
-29.32 |
2.9 |
-9.36 |
0.62 |
0 |
|
|
279234 |
103842212 |
1 |
BrNO2C15H18 |
ABC2D15E18 |
-54.9 |
3.72 |
-9.23 |
-0.41 |
0 |
|
|
279235 |
103842213 |
2 |
NOC6H9 |
ABC6D9 |
-93.34 |
4.21 |
-9.62 |
0.78 |
0 |
|
|
279236 |
103842214 |
1 |
FNOC15H18 |
ABCD15E18 |
-74.16 |
2.84 |
-9.49 |
-0.41 |
0 |
|
|
279237 |
103842218 |
1 |
NOF2C14H15 |
ABC2D14E15 |
-110.32 |
2.94 |
-9.28 |
-0.85 |
0 |
|
|
279238 |
103842219 |
1 |
ClON2C13H15 |
ABC2D13E15 |
-15.58 |
3.92 |
-9.37 |
-0.88 |
0 |
|
|
279239 |
103842220 |
1 |
BrNOSC12H14 |
ABCDE12F14 |
-14.38 |
3.38 |
-9.34 |
-1.01 |
0 |
|
|
279240 |
103842223 |
1 |
NO2C12H21 |
AB2C12D21 |
-104.25 |
2.67 |
-9.24 |
1.08 |
0 |
|
|
279241 |
103842230 |
1 |
BrNOSC12H14 |
ABCDE12F14 |
-5.89 |
3.49 |
-9.43 |
-0.95 |
0 |
|
|
279242 |
103842231 |
2 |
NOC8H9 |
ABC8D9 |
-63.06 |
4.68 |
-9.24 |
-0.6 |
0 |
|
|
279243 |
103842237 |
1 |
BrNO2C15H18 |
ABC2D15E18 |
-57.82 |
4.0 |
-9.06 |
-0.57 |
0 |
|
|
279244 |
103842243 |
1 |
NOSC12H15 |
ABCD12E15 |
-14.48 |
3.8 |
-9.36 |
-0.65 |
0 |
|
|
279245 |
103842260 |
1 |
NOF4C15H15 |
ABC4D15E15 |
-228.65 |
4.09 |
-9.34 |
-1.14 |
0 |
|
|
279246 |
103842261 |
1 |
NOF4C15H15 |
ABC4D15E15 |
-226.99 |
6.65 |
-9.66 |
-1.16 |
0 |
|
|
279247 |
103842267 |
1 |
ON2C12H18 |
AB2C12D18 |
-30.14 |
1.6 |
-9.45 |
0.78 |
0 |
|
|
279248 |
103842277 |
1 |
BrON2C13H15 |
ABC2D13E15 |
-5.91 |
3.66 |
-9.52 |
-1.01 |
0 |
|
|
279249 |
103842286 |
1 |
BrClNOC13H17 |
ABCDE13F17 |
-43.86 |
4.26 |
-9.48 |
-0.76 |
0 |