Geometry & MOs

Info

ID:	148018
PubChem CID:	53787680
Reduced:	NS2C11H15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	515.070712
ΔH_f, kcal/mol:	28.13
Dipole, Da:	6.27
IP(EA), eV:	-8.7(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-[[methoxycarbonyl-[4-(trifluoromethoxy)phenyl]carbamoyl]hydrazinylidene]-2-methyl-1H-indene-2-carboperoxoic acid

Drug info:

PubChemData

Smile

CC.C1C(NC(=S)S1)C2=CC=CC=C2

DOS

IR

Vibrations