Geometry & MOs

Info

ID:	217297
PubChem CID:	85087576
Reduced:	O6C19H26 (1)
Stoich.:	A6B19C26 (1)
Weight, g/mol:	351.163457
ΔH_f, kcal/mol:	-234.03
Dipole, Da:	3.5
IP(EA), eV:	-9.14(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[11-acetyl-6-(2-fluoroethyl)-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-yl]ethanone

Drug info:

PubChemData

Smile

CC(C=CC(C(=O)OC)OC(=O)C)C(COCC1=CC=CC=C1)OC

DOS

IR

Vibrations