Geometry & MOs

Info

ID:	200071
PubChem CID:	79343368
Reduced:	OSN2H16C17 (1)
Stoich.:	ABC2D16E17 (1)
Weight, g/mol:	312.104084
ΔH_f, kcal/mol:	74.95
Dipole, Da:	3.44
IP(EA), eV:	-8.72(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-6-fluoro-1-[2-methyl-3-(propylamino)propyl]indole-2,3-dione

Drug info:

PubChemData

Smile

C1CC1NCC=CC2=CC=C(O2)C3=NC4=CC=CC=C4S3

DOS

IR

Vibrations