Geometry & MOs

Info

ID:	228861
PubChem CID:	87565997
Reduced:	ZrCl2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	670.060261
ΔH_f, kcal/mol:	114.23
Dipole, Da:	5.77
IP(EA), eV:	-7.39(-2.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6,11,12-tetrakis(2-chlorophenyl)tetracene

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC[C-]=C1.C=[Zr+2].C1C=CC=[C-]1.Cl.Cl

DOS

IR

Vibrations