N-(2-{(4-Bromophenyl)[(1-Methyl-1H-Imidazol-5-Yl)Methyl]Amino}Ethyl)-1-Methyl-N-(2-Methylbenzyl)-1H-Imidazole-4-Sulfonamide

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Properties Simple | Detailed

Formula C25H29BrN6O2S
IUPAC Name n-[2-[4-bromo-n-[(3-methylimidazol-4-yl)methyl]anilino]ethyl]-1-methyl-n-(o-tolylmethyl)imidazole-4-sulfonamide
Molecular Mass 557.506 g·mol−1
Heat of Formation 138.3 ± 16.7 kJ·mol−1
Dipole Moment 11.40 ± 1.08 D
Volume 608.8 Å 3
Surface Area 437.88 Å 2
HOMO Energy -8.06 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
InChIKey FOPZJCZMMFSDOL-UHFFFAOYSA-N
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Elements C H O N S Br