Geometry & MOs

Info

ID:	56318
PubChem CID:	17425090
Reduced:	O7H14C17 (1)
Stoich.:	A7B14C17 (1)
Weight, g/mol:	290.108899
ΔH_f, kcal/mol:	-207.54
Dipole, Da:	2.9
IP(EA), eV:	-8.69(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,5-dimethylphenyl)methylsulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1O)C(=O)OCC(=O)C2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations