Geometry & MOs

Info

ID:	215906
PubChem CID:	85085420
Reduced:	OC6H7 (2)
Stoich.:	AB6C7 (2)
Weight, g/mol:	190.09938
ΔH_f, kcal/mol:	-69.37
Dipole, Da:	4.04
IP(EA), eV:	-9.55(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-methylbut-1-enyl)-1,3-benzodioxole

Drug info:

PubChemData

Smile

C1CC(C(=O)C1CC2=CC=CC=C2)O

DOS

IR

Vibrations