Geometry & MOs

Info

ID:	385079
PubChem CID:	134978274
Reduced:	SiO2C23H44 (1)
Stoich.:	AB2C23D44 (1)
Weight, g/mol:	256.125201
ΔH_f, kcal/mol:	-145.19
Dipole, Da:	2.98
IP(EA), eV:	-9.02(1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,4Z,10Z,12E)-5,10-dimethylbicyclo[12.4.0]octadeca-1(18),2,4,10,12,14,16-heptaen-6,8-diyne

Drug info:

PubChemData

Smile

CC(CCCCCCC#CCC[Si](C)(C)C(C)(C)C)OC1CCCCO1

DOS

IR

Vibrations