Geometry & MOs

Info

ID:	52178
PubChem CID:	12014977
Reduced:	N3C10H11 (1)
Stoich.:	A3B10C11 (1)
Weight, g/mol:	171.079647
ΔH_f, kcal/mol:	87.11
Dipole, Da:	4.4
IP(EA), eV:	-9.09(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-prop-2-ynylbenzimidazol-1-amine

Drug info:

PubChemData

Smile

C=CCNN1C=NC2=CC=CC=C21

DOS

IR

Vibrations