Geometry & MOs

Info

ID:	408684
PubChem CID:	135081452
Reduced:	ZrCl2C24H24 (1)
Stoich.:	AB2C24D24 (1)
Weight, g/mol:	312.187801
ΔH_f, kcal/mol:	-38.53
Dipole, Da:	2.38
IP(EA), eV:	-7.57(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC=C[C]2[C]1[CH][C]([C]2CC[C]3[C]([CH][C]4[C]3C=CC=C4C)C)C.Cl[Zr]Cl

DOS

IR

Vibrations