Geometry & MOs

Info

ID:	185582
PubChem CID:	77316505
Reduced:	ClN2F3O5H26C32 (1)
Stoich.:	AB2C3D5E26F32 (1)
Weight, g/mol:	439.085432
ΔH_f, kcal/mol:	-255.63
Dipole, Da:	5.79
IP(EA), eV:	-9.07(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-4'-(5-chlorocyclohexa-2,4-dien-1-yl)-6'-pyridin-3-ylspiro[1H-indole-3,5'-piperidine]-2,2'-dione

Drug info:

PubChemData

Smile

C1C(C2(C(NC1=O)C3=C(C=CC(=C3)F)OC4=CC=C(C=C4)OCCO)C5=C(C=C(C=C5)Cl)NC2=O)C6C=C(C=CC6F)F

DOS

IR

Vibrations