Geometry & MOs

Info

ID:	424283
PubChem CID:	135122029
Reduced:	NSO3H15C18 (1)
Stoich.:	ABC3D15E18 (1)
Weight, g/mol:	339.102606
ΔH_f, kcal/mol:	-55.11
Dipole, Da:	6.24
IP(EA), eV:	-8.69(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[N-(4-chlorophenyl)-C-(2-methylpropyl)carbonimidoyl]indene-1,3-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=CC(=C(S3)N)C(=O)O

DOS

IR

Vibrations