Geometry & MOs

Info

ID:	401718
PubChem CID:	135052266
Reduced:	N4C12H29 (1)
Stoich.:	A4B12C29 (1)
Weight, g/mol:	270.092376
ΔH_f, kcal/mol:	3.74
Dipole, Da:	2.93
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.756729
Charge, e:	0

Chem-info

IUPAC name:

2-benzhydryl-1H-imidazol-1-ium;chloride

Drug info:

PubChemData

Smile

CC(C)(C)C(=[N+](C)C)NC(N(C)C)N(C)C

DOS

IR

Vibrations