Geometry & MOs

Info

ID:	384782
PubChem CID:	134977660
Reduced:	O2C11H18 (1)
Stoich.:	A2B11C18 (1)
Weight, g/mol:	616.000996
ΔH_f, kcal/mol:	-77.9
Dipole, Da:	1.82
IP(EA), eV:	-9.93(1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,4Z,8R)-1-[tert-butyl(dimethyl)silyl]oxy-8-hydroxybicyclo[7.3.1]tridec-4-en-2,6-diyn-13-one;carbon monoxide;cobalt

Drug info:

PubChemData

Smile

CCCCC#CCCC1OCCO1

DOS

IR

Vibrations