List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
19181 |
556891 |
1 |
BrO2C6H11 |
AB2C6D11 |
-17.71 |
3.2 |
-9.92 |
-0.01 |
0 |
|
|
19182 |
556919 |
1 |
O2C15H20 |
A2B15C20 |
-62.4 |
6.46 |
-9.2 |
-0.15 |
0 |
|
|
19183 |
556921 |
1 |
N3O3C16H19 |
A3B3C16D19 |
-11.6 |
8.64 |
-8.8 |
-0.55 |
0 |
|
|
19184 |
556948 |
1 |
ClO2N5H12C14 |
AB2C5D12E14 |
23.19 |
4.27 |
-8.72 |
-0.59 |
0 |
|
|
19185 |
556961 |
4 |
C5H8 |
A5B8 |
-17.53 |
1.82 |
-8.98 |
1.33 |
0 |
|
|
19186 |
556962 |
1 |
IC10H17 |
AB10C17 |
29.82 |
1.38 |
-9.63 |
-0.6 |
0 |
|
|
19187 |
557036 |
1 |
OC9H14 |
AB9C14 |
-52.78 |
2.82 |
-9.66 |
0.75 |
0 |
|
|
19188 |
557054 |
1 |
O3C8H12 |
A3B8C12 |
-110.85 |
2.99 |
-9.92 |
1.76 |
0 |
|
|
19189 |
557100 |
2 |
BrC3H5 |
AB3C5 |
-28.16 |
2.61 |
-10.55 |
-0.42 |
0 |
|
|
19190 |
557212 |
1 |
NO2C16H23 |
AB2C16D23 |
-37.46 |
4.16 |
-9.46 |
0.25 |
0 |
|
|
19191 |
557224 |
1 |
O4C11H18 |
A4B11C18 |
-176.58 |
2.07 |
-10.24 |
0.5 |
0 |
|
|
19192 |
557261 |
1 |
SO3N4C12H20 |
AB3C4D12E20 |
-78.54 |
5.63 |
-9.49 |
0.04 |
0 |
|
|
19193 |
557264 |
1 |
O2C7H10 |
A2B7C10 |
-65.25 |
5.32 |
-11.0 |
-0.48 |
0 |
|
|
19194 |
557399 |
1 |
ClN2O3H17C19 |
AB2C3D17E19 |
-45.63 |
2.82 |
-9.02 |
-0.68 |
0 |
|
|
19195 |
557446 |
2 |
OC7H10 |
AB7C10 |
-98.87 |
3.85 |
-9.23 |
0.23 |
0 |
|
|
19196 |
557476 |
1 |
O2C13H22 |
A2B13C22 |
-123.3 |
3.27 |
-9.83 |
0.59 |
0 |
|
|
19197 |
557514 |
1 |
SC11H22 |
AB11C22 |
-47.71 |
1.62 |
-8.34 |
1.01 |
0 |
|
|
19198 |
557662 |
1 |
N3O3C12H19 |
A3B3C12D19 |
-114.12 |
7.47 |
-9.66 |
0.04 |
0 |
|
|
19199 |
557666 |
4 |
OC2H3 |
AB2C3 |
-196.2 |
4.39 |
-10.77 |
0.42 |
0 |
|
|
19200 |
557679 |
1 |
FSN2O3C12H15 |
ABC2D3E12F15 |
-151.51 |
6.28 |
-9.34 |
-0.66 |
0 |
|
|
19201 |
557747 |
1 |
ClC6H11 |
AB6C11 |
-21.81 |
2.32 |
-9.96 |
1.18 |
0 |
|
|
19202 |
557769 |
1 |
BNOC7H18 |
ABCD7E18 |
-113.63 |
1.17 |
-9.29 |
1.16 |
0 |
|
|
19203 |
557813 |
1 |
O2C9H14 |
A2B9C14 |
-91.1 |
2.45 |
-10.23 |
0.08 |
0 |
|
|
19204 |
557830 |
1 |
O5C16H20 |
A5B16C20 |
-171.4 |
10.52 |
-10.0 |
-0.78 |
0 |
|
|
19205 |
557842 |
1 |
O2C15H24 |
A2B15C24 |
-116.13 |
2.26 |
-10.08 |
0.16 |
0 |
|
|
19206 |
557856 |
1 |
SO2C9H16 |
AB2C9D16 |
-91.9 |
3.33 |
-8.63 |
0.29 |
0 |
|
|
19207 |
557871 |
2 |
NOC4H8 |
ABC4D8 |
-18.97 |
4.64 |
-9.16 |
0.16 |
0 |
|
|
19208 |
557906 |
1 |
BrOC18H37 |
ABC18D37 |
-129.92 |
3.34 |
-10.4 |
-0.05 |
0 |
|
|
19209 |
558026 |
1 |
N2O4C53H82 |
A2B4C53D82 |
-240.46 |
7.26 |
-8.56 |
0.7 |
0 |
|
|
19210 |
558056 |
1 |
O2C13H20 |
A2B13C20 |
-114.11 |
2.95 |
-9.98 |
0.43 |
0 |
|
|
19211 |
558114 |
1 |
ClPC17H26 |
ABC17D26 |
-56.6 |
3.01 |
-9.07 |
0.45 |
0 |
|
|
19212 |
558120 |
2 |
OC9H15 |
AB9C15 |
-117.56 |
2.25 |
-10.34 |
0.9 |
0 |
|
|
19213 |
558182 |
1 |
NSiO2C9H15 |
ABC2D9E15 |
-55.01 |
3.03 |
-9.38 |
0.02 |
0 |
|
|
19214 |
558214 |
2 |
NO2C9H15 |
AB2C9D15 |
-91.72 |
3.91 |
-8.7 |
-0.58 |
0 |
|
|
19215 |
558222 |
1 |
N4O5H10C12 |
A4B5C10D12 |
-58.81 |
7.4 |
-9.93 |
-1.51 |
0 |
|
|
19216 |
558238 |
1 |
OC12H16 |
AB12C16 |
14.2 |
4.66 |
-8.63 |
-0.13 |
0 |
|
|
19217 |
558252 |
1 |
O4C27H48 |
A4B27C48 |
-282.83 |
1.94 |
-10.44 |
0.8 |
0 |
|
|
19218 |
558278 |
1 |
NO6C21H21 |
AB6C21D21 |
-114.04 |
7.45 |
-9.56 |
-1.4 |
0 |
|
|
19219 |
558288 |
1 |
NOC11H17 |
ABC11D17 |
-27.62 |
6.91 |
-8.68 |
0.36 |
0 |
|
|
19220 |
558296 |
2 |
O2C8H9 |
A2B8C9 |
-145.37 |
0.47 |
-8.67 |
-0.26 |
0 |
|
|
19221 |
558307 |
1 |
O2N3C11H17 |
A2B3C11D17 |
-7.1 |
3.7 |
-8.35 |
-0.02 |
0 |
|
|
19222 |
558323 |
1 |
NO4C25H33 |
AB4C25D33 |
-179.11 |
4.5 |
-8.22 |
-0.1 |
0 |
|
|
19223 |
558362 |
1 |
SO2N3C21H25 |
AB2C3D21E25 |
-61.95 |
4.47 |
-8.47 |
-1.07 |
0 |
|
|
19224 |
558363 |
1 |
NC6H13 |
AB6C13 |
7.81 |
1.56 |
-8.72 |
1.29 |
0 |
|
|
19225 |
558378 |
1 |
NO2C10H19 |
AB2C10D19 |
-126.12 |
3.99 |
-9.94 |
1.17 |
0 |
|
|
19226 |
558385 |
1 |
ClO2F3N3C29H31 |
AB2C3D3E29F31 |
-164.3 |
6.44 |
-8.65 |
-1.32 |
0 |
|
|
19227 |
558386 |
1 |
NO2C7H13 |
AB2C7D13 |
-107.84 |
4.62 |
-9.78 |
1.3 |
0 |
|
|
19228 |
558453 |
2 |
O2C4H5 |
A2B4C5 |
-170.79 |
2.08 |
-10.72 |
-0.45 |
0 |
|
|
19229 |
558469 |
1 |
O3C8H16 |
A3B8C16 |
-161.42 |
3.57 |
-10.01 |
1.72 |
0 |
|
|
19230 |
558517 |
1 |
NC10H21 |
AB10C21 |
-36.59 |
1.64 |
-8.68 |
3.27 |
0 |
|
|
19231 |
558614 |
1 |
O2C13H24 |
A2B13C24 |
-141.49 |
1.41 |
-10.38 |
0.96 |
0 |
|
|
19232 |
558650 |
2 |
O2N3C10H12 |
A2B3C10D12 |
-132.73 |
8.03 |
-9.57 |
-0.21 |
0 |
|
|
19233 |
558659 |
1 |
O2N3C10H11 |
A2B3C10D11 |
-47.59 |
7.48 |
-10.01 |
-0.33 |
0 |
|
|
19234 |
558674 |
1 |
NO3C12H23 |
AB3C12D23 |
-170.36 |
5.09 |
-9.8 |
1.28 |
0 |
|
|
19235 |
558730 |
1 |
ON2C12H16 |
AB2C12D16 |
-33.08 |
3.24 |
-8.67 |
0.05 |
0 |
|
|
19236 |
558731 |
2 |
NOC11H13 |
ABC11D13 |
-70.3 |
4.52 |
-8.73 |
0.17 |
0 |
|
|
19237 |
558734 |
1 |
BrNOC10H18 |
ABCD10E18 |
-82.75 |
6.26 |
-9.85 |
-0.13 |
0 |
|
|
19238 |
558746 |
1 |
N2O5C7H10 |
A2B5C7D10 |
-218.02 |
4.53 |
-10.47 |
-0.66 |
0 |
|
|
19239 |
558747 |
1 |
ON2C15H20 |
AB2C15D20 |
18.4 |
3.17 |
-9.2 |
0.31 |
0 |
|
|
19240 |
558758 |
1 |
ClO2N3C20H22 |
AB2C3D20E22 |
-47.58 |
4.34 |
-8.87 |
-0.91 |
0 |
|
|
19241 |
558769 |
1 |
NO3C8H13 |
AB3C8D13 |
-149.28 |
4.03 |
-9.87 |
0.46 |
0 |
|
|
19242 |
558776 |
1 |
O3N6C16H24 |
A3B6C16D24 |
-86.07 |
3.22 |
-8.87 |
-0.62 |
0 |
|
|
19243 |
558780 |
1 |
NO3C10H17 |
AB3C10D17 |
-138.05 |
4.31 |
-9.86 |
0.45 |
0 |
|
|
19244 |
558783 |
1 |
NOC13H27 |
ABC13D27 |
-81.86 |
2.62 |
-8.59 |
2.27 |
0 |
|
|
19245 |
558873 |
1 |
InC4H11 |
AB4C11 |
35.42 |
0.64 |
-9.77 |
2.04 |
0 |
|
|
19246 |
558900 |
1 |
SO2C8H12 |
AB2C8D12 |
-100.59 |
1.91 |
-8.95 |
0.18 |
0 |
|
|
19247 |
558939 |
1 |
N4O5C11H14 |
A4B5C11D14 |
-24.81 |
10.53 |
-9.57 |
-1.67 |
0 |
|
|
19248 |
558940 |
1 |
O3C11H16 |
A3B11C16 |
-107.19 |
1.47 |
-9.41 |
0.36 |
0 |
|
|
19249 |
558996 |
2 |
NC4H8 |
AB4C8 |
28.17 |
1.87 |
-8.49 |
1.05 |
0 |
|
|
19250 |
559007 |
1 |
OC7H14 |
AB7C14 |
-55.36 |
0.48 |
-8.76 |
1.48 |
0 |
|
|
19251 |
559097 |
1 |
OC8H16 |
AB8C16 |
-86.36 |
2.29 |
-10.18 |
2.95 |
0 |
|
|
19252 |
559100 |
1 |
O2C9H16 |
A2B9C16 |
-91.05 |
2.84 |
-9.57 |
0.74 |
0 |
|
|
19253 |
559120 |
1 |
SO5C15H30 |
AB5C15D30 |
-270.71 |
4.35 |
-9.12 |
0.19 |
0 |
|
|
19254 |
559123 |
1 |
O5C14H20 |
A5B14C20 |
-166.13 |
7.0 |
-10.03 |
0.5 |
0 |
|
|
19255 |
559170 |
1 |
NO2C8H17 |
AB2C8D17 |
-122.7 |
5.74 |
-9.91 |
0.9 |
0 |