Geometry & MOs

Info

ID:	335537
PubChem CID:	127254399
Reduced:	ON2H7C8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	557.163851
ΔH_f, kcal/mol:	36.24
Dipole, Da:	4.67
IP(EA), eV:	-9.12(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,2R)-1-benzoyl-2-(4-fluorophenyl)-1',3'-dioxospiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-9-yl] acetate

Drug info:

PubChemData

Smile

CC1=C(N(C(=N1)C2=CN=CC=C2)O)C(=O)NC3=CC=CC=C3

DOS

IR

Vibrations