Geometry & MOs

Info

ID:	224944
PubChem CID:	85734962
Reduced:	BCl2H29C32 (1)
Stoich.:	AB2C29D32 (1)
Weight, g/mol:	564.093042
ΔH_f, kcal/mol:	17.32
Dipole, Da:	0.64
IP(EA), eV:	-8.66(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(3,5-dichloro-2,4,6-trimethylphenyl)-phenanthren-9-ylborane

Drug info:

PubChemData

Smile

B(C1=CC2=CC=CC=C2C3=CC=CC=C13)(C4=C(C(=C(C=C4C)C)Cl)C)C5=C(C(=C(C=C5C)C)Cl)C

DOS

IR

Vibrations