Geometry & MOs

Info

ID:	400828
PubChem CID:	135049178
Reduced:	CrO6C19H24 (1)
Stoich.:	AB6C19D24 (1)
Weight, g/mol:	260.12322
ΔH_f, kcal/mol:	-65.36
Dipole, Da:	1.23
IP(EA), eV:	-7.4(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-1-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxybut-2-enylidene]chromium

Drug info:

PubChemData

Smile

C/C=C/C(=[Cr])O[C@H]1C[C@H](CC[C@@H]1C(C)C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]

DOS

IR

Vibrations