Geometry & MOs

Info

ID:	408972
PubChem CID:	135081745
Reduced:	ZrCl2H18C21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	270.140851
ΔH_f, kcal/mol:	245.76
Dipole, Da:	6.81
IP(EA), eV:	-5.49(-4.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C[C]1[CH][CH][C]([CH]1)CC[C]2[C]3C=CC=C[C]3[C]4[C]2C=CC=C4.Cl[Zr]Cl

DOS

IR

Vibrations