Geometry & MOs

Info

ID:	71901
PubChem CID:	48415598
Reduced:	FOSN4H21C22 (1)
Stoich.:	ABCD4E21F22 (1)
Weight, g/mol:	321.184112
ΔH_f, kcal/mol:	1.93
Dipole, Da:	6.56
IP(EA), eV:	-9.01(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-2-(4-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)N(C)CCCC3=NC4=CC=CC=C4N3

DOS

IR

Vibrations