Geometry & MOs

Info

ID:	438779
PubChem CID:	135228535
Reduced:	NO3C21H31 (1)
Stoich.:	AB3C21D31 (1)
Weight, g/mol:	345.266779
ΔH_f, kcal/mol:	-144.74
Dipole, Da:	2.14
IP(EA), eV:	-9.15(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-2-phenylbutyl)-5,5-dimethyl-2-propan-2-ylcyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1CCC(CC1C(=O)NCC(=O)C2=CC=C(C=C2)OC)(C)C

DOS

IR

Vibrations