Geometry & MOs

Info

ID:	335853
PubChem CID:	127254715
Reduced:	ON4C21H26 (1)
Stoich.:	AB4C21D26 (1)
Weight, g/mol:	571.191422
ΔH_f, kcal/mol:	19.66
Dipole, Da:	4.97
IP(EA), eV:	-8.58(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-7-chloro-1-(4-methylbenzoyl)-2-(4-propan-2-ylphenyl)spiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1',3'-dione

Drug info:

PubChemData

Smile

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)CCCCCN3C=CC=C3

DOS

IR

Vibrations