Geometry & MOs

Info

ID:	406378
PubChem CID:	135077395
Reduced:	OS2C16H20 (1)
Stoich.:	AB2C16D20 (1)
Weight, g/mol:	515.987684
ΔH_f, kcal/mol:	2.99
Dipole, Da:	1.37
IP(EA), eV:	-8.58(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

carbon monoxide;cobalt;1,1,4,4-tetraethoxybut-2-yne

Drug info:

PubChemData

Smile

CCCCC#CC1(SCCS1)C2=CC=C(C=C2)OC

DOS

IR

Vibrations