Geometry & MOs

Info

ID:	233947
PubChem CID:	92297406
Reduced:	OC3H3 (6)
Stoich.:	AB3C3 (6)
Weight, g/mol:	362.151809
ΔH_f, kcal/mol:	-186.4
Dipole, Da:	6.34
IP(EA), eV:	-8.47(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-6-[(1S)-1-(4-phenylmethoxyphenyl)ethyl]-1,3-benzodioxole

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)OCC(=O)O)C2=CC3=C(C=C2OC)OCO3

DOS

IR

Vibrations