Geometry & MOs

Info

ID:	22165
PubChem CID:	596135
Reduced:	OH4C5 (3)
Stoich.:	AB4C5 (3)
Weight, g/mol:	240.078644
ΔH_f, kcal/mol:	-55.28
Dipole, Da:	4.82
IP(EA), eV:	-8.98(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1,4-benzodioxin-6-yl(phenyl)methanone

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=CC(=C2)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations