Geometry & MOs

Info

ID:	2808
PubChem CID:	8607
Reduced:	NSO2Cl3H4C9 (1)
Stoich.:	ABC2D3E4F9 (1)
Weight, g/mol:	294.902833
ΔH_f, kcal/mol:	-37.52
Dipole, Da:	5.55
IP(EA), eV:	-9.6(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(trichloromethylsulfanyl)isoindole-1,3-dione

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl

DOS

IR

Vibrations