Formula |
C28H29ClN2O3S |
IUPAC Name |
2-[2-[1-(2-chlorophenyl)-1-methyl-ethyl]-1-[4-(3-methylsulfonylphenyl)phenyl]imidazol-4-yl]propan-2-ol |
Molecular Mass |
509.059 g·mol−1 |
Heat of Formation |
-283.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.02 ± 1.08 D |
Volume |
590.67 Å 3 |
Surface Area |
463.96 Å 2 |
HOMO Energy |
-9.07 ± 0.55 eV |
LUMO Energy |
-1.01 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
JLPURTXCSILYLW-UHFFFAOYSA-N |
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Elements |
C
Cl
H
O
N
S
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