Geometry & MOs

Info

ID:	408692
PubChem CID:	135081460
Reduced:	ZrCl2C30H36 (1)
Stoich.:	AB2C30D36 (1)
Weight, g/mol:	396.281701
ΔH_f, kcal/mol:	-15.72
Dipole, Da:	3.38
IP(EA), eV:	-7.64(-1.82)
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)C(C)(C)[C]2[C]3[C](C=CC=C3C(C)(C)C)[C]4[C]2C(=CC=C4)C(C)(C)C.Cl[Zr]Cl

DOS

IR

Vibrations