Geometry & MOs

Info

ID:	297817
PubChem CID:	117632861
Reduced:	FNOH16C19 (1)
Stoich.:	ABCD16E19 (1)
Weight, g/mol:	428.17475
ΔH_f, kcal/mol:	19.22
Dipole, Da:	4.97
IP(EA), eV:	-9.26(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-(7-fluoro-3-oxo-1,2-dihydroinden-5-yl)-3-[6-(3-methoxybutoxy)pyridin-3-yl]oxypyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1CN(C1)C(=O)C2=CC=C(C=C2)C#CC3=CC(=CC=C3)F

DOS

IR

Vibrations