Geometry & MOs

Info

ID:	371051
PubChem CID:	127342243
Reduced:	FO2N4C21H21 (1)
Stoich.:	AB2C4D21E21 (1)
Weight, g/mol:	338.210661
ΔH_f, kcal/mol:	-54.89
Dipole, Da:	1.54
IP(EA), eV:	-8.8(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-imidazol-1-ylphenyl)methyl]-8-azaspiro[4.5]decane-8-carboxamide

Drug info:

PubChemData

Smile

C1CC2=C(C1NC(=O)N3CCN(CC3)C4=NC5=CC=CC=C5O4)C=CC=C2F

DOS

IR

Vibrations