Geometry & MOs

Info

ID:	35741
PubChem CID:	7980271
Reduced:	NSO7C19H21 (1)
Stoich.:	ABC7D19E21 (1)
Weight, g/mol:	314.079038
ΔH_f, kcal/mol:	-261.6
Dipole, Da:	8.47
IP(EA), eV:	-8.8(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC(=C1COC(=O)COC2=CC=CC=C2)C(=O)OCC)N

DOS

IR

Vibrations