Geometry & MOs

Info

ID:	295433
PubChem CID:	117528650
Reduced:	N3C17H21 (1)
Stoich.:	A3B17C21 (1)
Weight, g/mol:	245.189198
ΔH_f, kcal/mol:	56.55
Dipole, Da:	4.44
IP(EA), eV:	-8.92(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethyl-3-methylbenzimidazol-5-yl)-N-methylbutan-1-amine

Drug info:

PubChemData

Smile

CC(C)C(C#N)C1=CC2=C(C=C1)N=C(N2C)C3CCC3

DOS

IR

Vibrations