Geometry & MOs

Info

ID:	273351
PubChem CID:	103770952
Reduced:	NO3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	265.147807
ΔH_f, kcal/mol:	-119.05
Dipole, Da:	1.78
IP(EA), eV:	-9.07(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(4-fluorophenyl)-N-(2-hydroxy-4-methylpentyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)/C=C/C1=CC(=CC=C1)OC)O

DOS

IR

Vibrations