Geometry & MOs

Info

ID:	396743
PubChem CID:	135029126
Reduced:	ClO3H11C16 (1)
Stoich.:	AB3C11D16 (1)
Weight, g/mol:	286.102521
ΔH_f, kcal/mol:	-57.32
Dipole, Da:	5.57
IP(EA), eV:	-9.62(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-oxo-2-(2-trimethylsilylethynyl)-1H-indene-2-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=O)C(O2)(C3=CC=C(C=C3)Cl)O

DOS

IR

Vibrations