Geometry & MOs

Info

ID:	335936
PubChem CID:	127254943
Reduced:	N2O2C25H30 (1)
Stoich.:	A2B2C25D30 (1)
Weight, g/mol:	559.179501
ΔH_f, kcal/mol:	-38.09
Dipole, Da:	6.84
IP(EA), eV:	-8.33(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-7-fluoro-1-(3-methoxybenzoyl)-2-(4-methoxyphenyl)spiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1',3'-dione

Drug info:

PubChemData

Smile

COC1=CC=C(C2=CC=CC=C21)C3CCCN3C(=O)CCCCCN4C=CC=C4

DOS

IR

Vibrations