Geometry & MOs

Info

ID:	72180
PubChem CID:	48415896
Reduced:	O2N3C16H17 (1)
Stoich.:	A2B3C16D17 (1)
Weight, g/mol:	349.215413
ΔH_f, kcal/mol:	-6.67
Dipole, Da:	4.78
IP(EA), eV:	-9.13(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-4-tert-butyl-N-methylbenzamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC=CO3

DOS

IR

Vibrations