Geometry & MOs

Info

ID:	220786
PubChem CID:	85239783
Reduced:	NO3C15H17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	262.196421
ΔH_f, kcal/mol:	-39.34
Dipole, Da:	2.65
IP(EA), eV:	-9.3(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[tert-butyl(dimethyl)silyl]oxy-2-propan-2-ylbutane-1,3-diol

Drug info:

PubChemData

Smile

C=CCOCC1=C(C=CC(=C1)C(C#N)O)OCC=C

DOS

IR

Vibrations