Geometry & MOs

Info

ID:	336276
PubChem CID:	127255283
Reduced:	NOC6H7 (3)
Stoich.:	ABC6D7 (3)
Weight, g/mol:	563.105499
ΔH_f, kcal/mol:	-87.3
Dipole, Da:	4.57
IP(EA), eV:	-8.65(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S)-1-benzoyl-2-(2,4-dichlorophenyl)-8-methylspiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1',3'-dione

Drug info:

PubChemData

Smile

C1C(=O)NC2=C(O1)C=C(C=C2)NC(=O)CCCCCN3C=CC=C3

DOS

IR

Vibrations