Geometry & MOs

Info

ID:	6770
PubChem CID:	69911
Reduced:	OH12C16 (1)
Stoich.:	AB12C16 (1)
Weight, g/mol:	220.088815
ΔH_f, kcal/mol:	19.82
Dipole, Da:	3.41
IP(EA), eV:	-8.6(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-anthracen-9-ylethanone

Drug info:

PubChemData

Smile

CC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31

DOS

IR

Vibrations