Geometry & MOs

Info

ID:	405951
PubChem CID:	135076050
Reduced:	CrNO6H15C21 (1)
Stoich.:	ABC6D15E21 (1)
Weight, g/mol:	289.055869
ΔH_f, kcal/mol:	43.58
Dipole, Da:	2.5
IP(EA), eV:	-7.64(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[1-[(E)-but-2-enyl]indol-7-yl]-1-methoxyprop-2-ynylidene]chromium

Drug info:

PubChemData

Smile

C/C=C/CN1C=CC2=C1C(=CC=C2)C#CC(=[Cr])OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]

DOS

IR

Vibrations