Geometry & MOs

Info

ID:	55153
PubChem CID:	17389828
Reduced:	NO7C12H17 (1)
Stoich.:	AB7C12D17 (1)
Weight, g/mol:	267.029835
ΔH_f, kcal/mol:	-264.21
Dipole, Da:	4.15
IP(EA), eV:	-8.61(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-chlorophenoxy)methyl]-5-methyl-1,2-oxazole-3-carboxylic acid

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)C(CO)N.C(=O)(C(=O)O)O

DOS

IR

Vibrations