Geometry & MOs

Info

ID:	148442
PubChem CID:	53788104
Reduced:	NSF2O2H11C13 (1)
Stoich.:	ABC2D2E11F13 (1)
Weight, g/mol:	207.992722
ΔH_f, kcal/mol:	-91.91
Dipole, Da:	3.7
IP(EA), eV:	-8.87(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloronaphthalene-1,2,4-trione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CN=C(O2)S(=O)C=CCC(F)F

DOS

IR

Vibrations