Geometry & MOs

Info

ID:	35765
PubChem CID:	7980298
Reduced:	NO4C20H21 (1)
Stoich.:	AB4C20D21 (1)
Weight, g/mol:	326.079038
ΔH_f, kcal/mol:	-117.69
Dipole, Da:	2.24
IP(EA), eV:	-8.73(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-hydroxy-2-oxochromen-4-yl)methyl 2-phenoxyacetate

Drug info:

PubChemData

Smile

C[C@H]1CC2=CC=CC=C2N1C(=O)[C@H](C)OC(=O)COC3=CC=CC=C3

DOS

IR

Vibrations