Geometry & MOs

Info

ID:	206817
PubChem CID:	80305131
Reduced:	OSN2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	287.132157
ΔH_f, kcal/mol:	8.77
Dipole, Da:	2.7
IP(EA), eV:	-9.14(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-hydroxy-5-methylbenzamide

Drug info:

PubChemData

Smile

CC(C1=CN(C=C1)CC2=NC=CS2)O

DOS

IR

Vibrations