Geometry & MOs

Info

ID:	273227
PubChem CID:	103770720
Reduced:	NO3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	267.1293
ΔH_f, kcal/mol:	-143.68
Dipole, Da:	1.77
IP(EA), eV:	-9.22(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-2-methylsulfanylbenzamide

Drug info:

PubChemData

Smile

CCC(C(=O)NCC(CC(C)C)O)OC1=CC=CC=C1

DOS

IR

Vibrations