Geometry & MOs

Info

ID:	226719
PubChem CID:	87557817
Reduced:	SiZrCl2C25H32 (1)
Stoich.:	ABC2D25E32 (1)
Weight, g/mol:	170.057909
ΔH_f, kcal/mol:	0.48
Dipole, Da:	3.14
IP(EA), eV:	-7.46(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylidene-4,6-dioxoheptanoic acid

Drug info:

PubChemData

Smile

CC(=[Zr+2])C1=CC=CC=C1.C[Si](C)(C)C1=CC[C-]=C1.C1CCC2=C(C1)[CH-]C=C2.[Cl-].[Cl-]

DOS

IR

Vibrations