Geometry & MOs

Info

ID:	390543
PubChem CID:	134999646
Reduced:	NOSC14H17 (1)
Stoich.:	ABCD14E17 (1)
Weight, g/mol:	265.095023
ΔH_f, kcal/mol:	-17.3
Dipole, Da:	3.09
IP(EA), eV:	-9.25(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-hydroxy-3-(4-methoxyphenyl)-4H-1,2-oxazole-5-carboxylate

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C(CCC2=CC=CC=C2)O)C

DOS

IR

Vibrations