Geometry & MOs

Info

ID:	397301
PubChem CID:	135030014
Reduced:	SO2C18H20 (1)
Stoich.:	AB2C18D20 (1)
Weight, g/mol:	281.087435
ΔH_f, kcal/mol:	-51.87
Dipole, Da:	1.23
IP(EA), eV:	-8.93(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-5-(phenylsulfanylmethyl)-1,3-oxazole

Drug info:

PubChemData

Smile

C[C@@H](CC(=O)OC1=CC=CC=C1)SCCC2=CC=CC=C2

DOS

IR

Vibrations