Geometry & MOs

Info

ID:	396978
PubChem CID:	135029533
Reduced:	NOH8C9 (2)
Stoich.:	ABC8D9 (2)
Weight, g/mol:	281.087435
ΔH_f, kcal/mol:	-22.87
Dipole, Da:	4.25
IP(EA), eV:	-8.24(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylphenyl)-5-(phenylsulfanylmethyl)-1,3-oxazole

Drug info:

PubChemData

Smile

CCN1C2=C(C3=CC=CC=C31)C4=C(C=C2)C=C(N4)C(=O)OC

DOS

IR

Vibrations