Geometry & MOs

Info

ID:	407584
PubChem CID:	135080332
Reduced:	OC6H7 (2)
Stoich.:	AB6C7 (2)
Weight, g/mol:	227.131014
ΔH_f, kcal/mol:	-67.33
Dipole, Da:	1.9
IP(EA), eV:	-9.41(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1C(OCC1=O)CCC2=CC=CC=C2

DOS

IR

Vibrations