Geometry & MOs

Info

ID:	36700
PubChem CID:	8011480
Reduced:	NO5C25H25 (1)
Stoich.:	AB5C25D25 (1)
Weight, g/mol:	328.094688
ΔH_f, kcal/mol:	-132.73
Dipole, Da:	8.19
IP(EA), eV:	-8.9(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 2-(4-methoxyphenyl)acetate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations