Geometry & MOs

Info

ID:	208203
PubChem CID:	80503614
Reduced:	FNOC13H18 (1)
Stoich.:	ABCD13E18 (1)
Weight, g/mol:	231.089543
ΔH_f, kcal/mol:	-75.69
Dipole, Da:	1.41
IP(EA), eV:	-8.8(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-propan-2-ylphenyl)-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2CCCNCC2)F

DOS

IR

Vibrations