N-[2-(1H-Benzimidazol-2-Yl)Ethyl]-2-(2-Bromophenoxy)Acetamide

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Properties Simple | Detailed

Formula C17H16BrN3O2
IUPAC Name n-[2-(benzimidazol-1-ium-7a-ylium-2-yl)ethyl]-2-(2-bromophenoxy)acetamide
Molecular Mass 374.232 g·mol−1
Heat of Formation -50.5 ± 16.7 kJ·mol−1
Dipole Moment 7.28 ± 1.08 D
Volume 379.26 Å 3
Surface Area 343.96 Å 2
HOMO Energy -8.80 ± 0.55 eV
LUMO Energy 2.34 ± eV
Point Group Symmetry C1
Synonyms
  • af-399/15033749
  • n-[2-(1h-benzimidazol-2-yl)ethyl]-2-(2-bromophenoxy)ethanamide
  • oprea1_398806
  • oprea1_657898
InChIKey XWFRNTHGPRGCNS-UHFFFAOYSA-N
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Elements H C Br O N