Geometry & MOs

Info

ID:	18714
PubChem CID:	546865
Reduced:	MoO2C15H21 (2)
Stoich.:	AB2C15D21 (2)
Weight, g/mol:	660.118388
ΔH_f, kcal/mol:	-85.03
Dipole, Da:	10.89
IP(EA), eV:	-7.66(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	-10

Chem-info

IUPAC name:

carbon monoxide;1,3-ditert-butylcyclopentane;molybdenum

Drug info:

PubChemData

Smile

CC(C)(C)[C-]1[CH-][CH-][C-]([CH-]1)C(C)(C)C.CC(C)(C)[C-]1[CH-][CH-][C-]([CH-]1)C(C)(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mo].[Mo]

DOS

IR

Vibrations