Geometry & MOs

Info

ID:	220905
PubChem CID:	85240347
Reduced:	O3C18H22 (1)
Stoich.:	A3B18C22 (1)
Weight, g/mol:	286.196421
ΔH_f, kcal/mol:	-60.32
Dipole, Da:	1.42
IP(EA), eV:	-9.37(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[3-[tert-butyl(dimethyl)silyl]oxycyclopentyl]acetate

Drug info:

PubChemData

Smile

CC1(OC(CC(O1)C#CCOCC2=CC=CC=C2)C=C)C

DOS

IR

Vibrations