Geometry & MOs

Info

ID:	168878
PubChem CID:	75033158
Reduced:	SO3C18H20 (1)
Stoich.:	AB3C18D20 (1)
Weight, g/mol:	286.105892
ΔH_f, kcal/mol:	-83.98
Dipole, Da:	3.07
IP(EA), eV:	-9.35(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 2-hydroxy-2-(5-trimethylsilylthiophen-2-yl)acetate

Drug info:

PubChemData

Smile

CCCCOC(=O)C(C1=CC=C(S1)C=CC2=CC=CC=C2)O

DOS

IR

Vibrations