Geometry & MOs

Info

ID:	290836
PubChem CID:	111281525
Reduced:	ON3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	331.237211
ΔH_f, kcal/mol:	9.96
Dipole, Da:	1.95
IP(EA), eV:	-8.62(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-(3-hydroxy-2-methylpropyl)-3-[3-(2-methylbenzimidazol-1-yl)propyl]guanidine

Drug info:

PubChemData

Smile

CCNC(=NCC1CC1)N(C)CC2=CC=CC=C2OC

DOS

IR

Vibrations