Geometry & MOs

Info

ID:	402822
PubChem CID:	135057421
Reduced:	OC17H18 (1)
Stoich.:	AB17C18 (1)
Weight, g/mol:	353.199094
ΔH_f, kcal/mol:	-14.95
Dipole, Da:	3.12
IP(EA), eV:	-9.21(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(methylcarbamoyl)-4-phenylphenyl]hexyl acetate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CCC2=CC=CC=C2C(=O)C

DOS

IR

Vibrations