Geometry & MOs

Info

ID:	411353
PubChem CID:	135084176
Reduced:	O2S2H8C11 (1)
Stoich.:	A2B2C8D11 (1)
Weight, g/mol:	170.13068
ΔH_f, kcal/mol:	-0.04
Dipole, Da:	3.13
IP(EA), eV:	-9.16(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-ethoxypropan-2-yloxy)-3-methylbut-1-yne

Drug info:

PubChemData

Smile

C1=COC(=C1)C(=O)/C=C(/C2=CC=CS2)\S

DOS

IR

Vibrations