Geometry & MOs

Info

ID:	226775
PubChem CID:	87558241
Reduced:	N2O3H20C24 (1)
Stoich.:	A2B3C20D24 (1)
Weight, g/mol:	410.014555
ΔH_f, kcal/mol:	-10.64
Dipole, Da:	3.86
IP(EA), eV:	-8.54(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

2-methylcyclopenta-1,3-diene;3-methyl-1H-inden-1-ide;propan-2-ylidenezirconium(2+);dichloride

Drug info:

PubChemData

Smile

COC(=O)/C=C/C1=CC(=C(C=C1)OCC2=CN=CC=C2)C3=CC4=C(C=C3)NC=C4

DOS

IR

Vibrations