Geometry & MOs

Info

ID:	265426
PubChem CID:	103520228
Reduced:	NSO3C10H13 (1)
Stoich.:	ABC3D10E13 (1)
Weight, g/mol:	231.092915
ΔH_f, kcal/mol:	-81.4
Dipole, Da:	2.55
IP(EA), eV:	-9.04(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,2-diethoxyethylsulfanyl)-4-methyl-1,3-oxazole

Drug info:

PubChemData

Smile

CC1=COC(=N1)SC(C2CC2)C(=O)OC

DOS

IR

Vibrations