Geometry & MOs

Info

ID:	385844
PubChem CID:	134980134
Reduced:	CrO7C15H16 (1)
Stoich.:	AB7C15D16 (1)
Weight, g/mol:	220.055535
ΔH_f, kcal/mol:	-4.95
Dipole, Da:	2.25
IP(EA), eV:	-7.26(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[methoxy-[(1R,2R,6S)-2-methoxy-6-methylcyclohex-3-en-1-yl]methylidene]chromium

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations