Geometry & MOs

Info

ID:	273302
PubChem CID:	103770859
Reduced:	N2O2S2C15H20 (1)
Stoich.:	A2B2C2D15E20 (1)
Weight, g/mol:	281.14495
ΔH_f, kcal/mol:	-66.14
Dipole, Da:	3.93
IP(EA), eV:	-9.18(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-2-(4-methylphenyl)sulfanylacetamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)CSC1=NC2=CC=CC=C2S1)O

DOS

IR

Vibrations