Geometry & MOs

Info

ID:	411754
PubChem CID:	135084588
Reduced:	ORhC4H9 (2)
Stoich.:	ABC4D9 (2)
Weight, g/mol:	281.146133
ΔH_f, kcal/mol:	-150.0
Dipole, Da:	9.72
IP(EA), eV:	-9.96(-6.51)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

[(5E)-5-(1-butylbenzimidazol-3-id-2-ylidene)cyclopenta-1,3-dien-1-yl]boronic acid

Drug info:

PubChemData

Smile

CCCCCCCC(O)O.[Rh].[Rh]

DOS

IR

Vibrations