Geometry & MOs

Info

ID:	400403
PubChem CID:	135047796
Reduced:	IrB2F8C20H29 (1)
Stoich.:	AB2C8D20E29 (1)
Weight, g/mol:	598.10375
ΔH_f, kcal/mol:	-535.18
Dipole, Da:	19.63
IP(EA), eV:	-8.07(-4.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

[B-](F)(F)(F)F.[B-](F)(F)(F)F.CC1=C([C](C(=C1C)C)C)C.CC(C)(C)C1=CC=CC=C1.[Ir]

DOS

IR

Vibrations