Geometry & MOs

Info

ID:	400412
PubChem CID:	135047820
Reduced:	CoHC5O5 (1)
Stoich.:	ABC5D5 (1)
Weight, g/mol:	502.16421
ΔH_f, kcal/mol:	-147.96
Dipole, Da:	26.26
IP(EA), eV:	-10.62(-4.76)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

2,3-dimethylbuta-1,3-diene;iridium;propan-2-one;tetrafluoroborate

Drug info:

PubChemData

Smile

[CH-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co]

DOS

IR

Vibrations