Geometry & MOs

Info

ID:	273461
PubChem CID:	103771161
Reduced:	NO2F3C14H18 (1)
Stoich.:	AB2C3D14E18 (1)
Weight, g/mol:	221.141579
ΔH_f, kcal/mol:	-251.96
Dipole, Da:	1.72
IP(EA), eV:	-10.08(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)benzamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=CC=C(C=C1)C(F)(F)F)O

DOS

IR

Vibrations