(1S)-1-(4-Chlorophenyl)-2-(1H-Imidazol-1-Yl)Ethyl (4-Isopropylphenyl)Carbamate

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Properties Simple | Detailed

Formula C21H22ClN3O2
IUPAC Name [(1s)-1-(4-chlorophenyl)-2-imidazol-1-yl-ethyl] n-(4-isopropylphenyl)carbamate
Molecular Mass 383.871 g·mol−1
Heat of Formation -128.6 ± 16.7 kJ·mol−1
Dipole Moment 1.77 ± 1.08 D
Volume 464.76 Å 3
Surface Area 394.79 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 2.35 ± eV
Point Group Symmetry C1
InChIKey JBMGTRUHKILUNG-HXUWFJFHSA-N
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Elements H C N O Cl