Geometry & MOs

Info

ID:	220706
PubChem CID:	85230600
Reduced:	SO2C11H14 (1)
Stoich.:	AB2C11D14 (1)
Weight, g/mol:	211.157229
ΔH_f, kcal/mol:	-70.16
Dipole, Da:	4.27
IP(EA), eV:	-8.6(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-3-methyl-1-piperidin-1-ylpent-4-en-1-one

Drug info:

PubChemData

Smile

CC1=C(CC2C1C=CC2C(=O)O)SC

DOS

IR

Vibrations