Geometry & MOs

Info

ID:	385369
PubChem CID:	134978889
Reduced:	OC13H16 (1)
Stoich.:	AB13C16 (1)
Weight, g/mol:	250.048736
ΔH_f, kcal/mol:	-30.86
Dipole, Da:	2.01
IP(EA), eV:	-9.32(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dichloro-(4-methyl-2-phenylcyclohexa-1,4-dien-1-yl)borane

Drug info:

PubChemData

Smile

C[C@]1(CC=C[C@@H](C1)C2=CC=CC=C2)O

DOS

IR

Vibrations