Geometry & MOs

Info

ID:	408987
PubChem CID:	135081760
Reduced:	ZrCl2H28C34 (1)
Stoich.:	AB2C28D34 (1)
Weight, g/mol:	484.354843
ΔH_f, kcal/mol:	223.04
Dipole, Da:	5.89
IP(EA), eV:	-6.87(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C[C]1[CH][C]2[C]([C]1CC[C]3[C]([CH][C]4[C]3C=CC=C4C5=CC=CC=C5)C)C=CC=C2C6=CC=CC=C6.Cl[Zr]Cl

DOS

IR

Vibrations