Geometry & MOs

Info

ID:	72198
PubChem CID:	48415915
Reduced:	ON2C11H12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	297.184112
ΔH_f, kcal/mol:	-6.93
Dipole, Da:	8.63
IP(EA), eV:	-9.0(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methylcyclohex-3-ene-1-carboxamide

Drug info:

PubChemData

Smile

CN(CCCC1=NC2=CC=CC=C2N1)C(=O)C3=CC=C(C=C3)NC(=O)C4CC4

DOS

IR

Vibrations