Geometry & MOs

Info

ID:	360582
PubChem CID:	127301227
Reduced:	ON4C23H26 (1)
Stoich.:	AB4C23D26 (1)
Weight, g/mol:	354.241962
ΔH_f, kcal/mol:	20.22
Dipole, Da:	3.17
IP(EA), eV:	-8.95(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-N-cycloheptylacetamide

Drug info:

PubChemData

Smile

C1CN(CCC1C2=NC3=CC=CC=C3N2)CC(=O)N4CCC5=CC=CC=C5C4

DOS

IR

Vibrations