Geometry & MOs

Info

ID:	234310
PubChem CID:	92298146
Reduced:	O3H8C9 (2)
Stoich.:	A3B8C9 (2)
Weight, g/mol:	328.094688
ΔH_f, kcal/mol:	-135.56
Dipole, Da:	1.41
IP(EA), eV:	-8.91(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3S)-3-(1,3-benzodioxol-5-yl)oxiran-2-yl]-(3,5-dimethoxyphenyl)methanone

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)C(=O)[C@@H]2[C@H](O2)C3=CC4=C(C=C3)OCO4)OC

DOS

IR

Vibrations