Geometry & MOs

Info

ID:	6787
PubChem CID:	70003
Reduced:	OC11H12 (1)
Stoich.:	AB11C12 (1)
Weight, g/mol:	160.088815
ΔH_f, kcal/mol:	-27.51
Dipole, Da:	3.57
IP(EA), eV:	-9.57(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7,8,9-tetrahydrobenzo[7]annulen-5-one

Drug info:

PubChemData

Smile

C1CCC(=O)C2=CC=CC=C2C1

DOS

IR

Vibrations