Geometry & MOs

Info

ID:	217282
PubChem CID:	85087550
Reduced:	SiO2C21H36 (1)
Stoich.:	AB2C21D36 (1)
Weight, g/mol:	348.248457
ΔH_f, kcal/mol:	-105.63
Dipole, Da:	3.29
IP(EA), eV:	-8.73(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[tert-butyl(dimethyl)silyl]oxy-3a-ethyl-2,3,4,5,8,9,9a,9b-octahydro-1H-cyclopenta[a]naphthalen-7-one

Drug info:

PubChemData

Smile

CCC=CC(=C(CC=C)C(C(=O)C=CC)OC(C)(C)C)[Si](C)(C)C

DOS

IR

Vibrations