Geometry & MOs

Info

ID:	273318
PubChem CID:	103770897
Reduced:	SN2O4C14H22 (1)
Stoich.:	AB2C4D14E22 (1)
Weight, g/mol:	272.152478
ΔH_f, kcal/mol:	-176.7
Dipole, Da:	3.91
IP(EA), eV:	-9.26(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)quinoline-5-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations