Geometry & MOs

Info

ID:	312381
PubChem CID:	126604530
Reduced:	OSH16C17 (1)
Stoich.:	ABC16D17 (1)
Weight, g/mol:	241.090292
ΔH_f, kcal/mol:	-9.74
Dipole, Da:	2.04
IP(EA), eV:	-8.65(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-11,12-dihydro-10H-benzo[d][2]benzazocin-5-one

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2=CC3=C(C=C2C)C(=O)CCS3

DOS

IR

Vibrations