Geometry & MOs

Info

ID:	282914
PubChem CID:	103945509
Reduced:	NO2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	301.090328
ΔH_f, kcal/mol:	-78.25
Dipole, Da:	4.35
IP(EA), eV:	-9.52(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(1-hydroxy-3-methylpentan-3-yl)-5-methylsulfanylbenzamide

Drug info:

PubChemData

Smile

CCC(C)(CCO)NC(=O)/C=C/C1=CC=CC=C1

DOS

IR

Vibrations