Geometry & MOs

Info

ID:	297988
PubChem CID:	117644710
Reduced:	FON7C25H28 (1)
Stoich.:	ABC7D25E28 (1)
Weight, g/mol:	538.02318
ΔH_f, kcal/mol:	9.68
Dipole, Da:	4.33
IP(EA), eV:	-8.53(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-bromo-2-cyclopropyl-1',1'-dioxospiro[2H-indole-3,4'-thiane]-1-yl)sulfonylbenzamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)NC3=NC(=C(C=C3C(=O)N)F)N[C@H](CC4=CC=CC=C4)[C@H](C)N)C=N1

DOS

IR

Vibrations