Geometry & MOs

Info

ID:	121373
PubChem CID:	50765548
Reduced:	ON3H23C24 (1)
Stoich.:	AB3C23D24 (1)
Weight, g/mol:	349.215413
ΔH_f, kcal/mol:	38.78
Dipole, Da:	2.99
IP(EA), eV:	-8.72(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(1-ethylbenzimidazol-2-yl)ethyl]phenyl]-3-methylbutanamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1CCC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

DOS

IR

Vibrations