Geometry & MOs

Info

ID:	282917
PubChem CID:	103945621
Reduced:	SN2O4C14H22 (1)
Stoich.:	AB2C4D14E22 (1)
Weight, g/mol:	290.124212
ΔH_f, kcal/mol:	-173.19
Dipole, Da:	0.46
IP(EA), eV:	-9.8(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-hydroxy-3-methylpentan-3-yl)-6-(trifluoromethyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations