Jc-1

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Properties Simple | Detailed

Formula C25H27Cl4N4+
IUPAC Name 5,6-dichloro-2-[(e)-3-(5,6-dichloro-1,3-diethylbenzimidazol-2-ylidene)prop-1-enyl]-1,3-diethylbenzimidazol-1-ium
Molecular Mass 525.321 g·mol−1
Heat of Formation 3488.9 ± 16.7 kJ·mol−1
Dipole Moment 11.03 ± 1.08 D
Volume 528.19 Å 3
Surface Area 451.27 Å 2
HOMO Energy -7.84 ± 0.55 eV
LUMO Energy -3.16 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-benzimidazolium, 5,6-dichloro-2-(3-(5,6-dichloro-1,3-diethyl-1,3-dihydro-2h-benzimidazol-2-ylidene)-1-propenyl)-1,3-diethyl-
  • 5,5',6,6'-tetrachloro-1,1',3,3'-tetraethylbenzimidazolocarbocyanine
  • 5,6-dichloro-2-[(e)-3-(5,6-dichloro-1,3-diethyl-2-benzimidazolylidene)prop-1-enyl]-1,3-diethylbenzimidazol-1-ium
  • 5,6-dichloro-2-[(e)-3-(5,6-dichloro-1,3-diethyl-benzimidazol-2-ylidene)prop-1-enyl]-1,3-diethyl-benzimidazol-1-ium
  • 5,6-dichloro-2-[3-(5,6-dichloro-1,3-diethyl-2-benzimidazolylidene)prop-1-enyl]-1,3-diethylbenzimidazol-1-ium
  • 5,6-dichloro-2-[3-(5,6-dichloro-1,3-diethyl-benzimidazol-2-ylidene)prop-1-enyl]-1,3-diethyl-benzimidazol-1-ium
  • 5,6-dichloro-2-[3-(5,6-dichloro-1,3-diethylbenzimidazol-2-ylidene)prop-1-enyl]-1,3-diethylbenzimidazol-1-ium
  • bas 00669813
  • molmap_000034
CAS Number(s)
  • 21527-78-6
InChIKey XKWQNWOHLZAFPS-UHFFFAOYSA-N
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Elements H C N Cl