Geometry & MOs

Info

ID:	18258
PubChem CID:	539226
Reduced:	OC3H4 (4)
Stoich.:	AB3C4 (4)
Weight, g/mol:	224.104859
ΔH_f, kcal/mol:	-160.99
Dipole, Da:	2.5
IP(EA), eV:	-8.85(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydro-1,4-benzodioxin-3-yl)butane-2,3-diol

Drug info:

PubChemData

Smile

CC(C(C)(C1COC2=CC=CC=C2O1)O)O

DOS

IR

Vibrations