N,N-Dichloro-2-(1H-Imidazol-4-Yl)Ethanamine

Molecule SVG Image

Properties Simple | Detailed

Formula C5H7Cl2N3
IUPAC Name n,n-dichloro-2-imidazol-3-ium-4-ylium-4-yl-ethanamine
Molecular Mass 180.035 g·mol−1
Heat of Formation 259.1 ± 16.7 kJ·mol−1
Dipole Moment 2.14 ± 1.08 D
Volume 192.19 Å 3
Surface Area 191.66 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy 1.69 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-imidazole-4-ethanamine, n,n-dichloro-
  • dichloro-[2-(3h-imidazol-4-yl)ethyl]amine
  • hisncl2
  • histamine dichloramine
  • n,n-dichloro-2-(3h-imidazol-4-yl)ethanamine
CAS Number(s)
  • 109241-52-3
InChIKey FPUBZCQSPWVHEM-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N Cl