Geometry & MOs

Info

ID:	294156
PubChem CID:	117428858
Reduced:	N2O3H14C15 (1)
Stoich.:	A2B3C14D15 (1)
Weight, g/mol:	270.100442
ΔH_f, kcal/mol:	-17.24
Dipole, Da:	6.55
IP(EA), eV:	-8.24(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-cyclopropyl-1,3-dihydroisoindol-5-yl)-1,2-oxazole-3-carboxylic acid

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C=CC(=C2C3=C(ON=C3)N)OC

DOS

IR

Vibrations