Geometry & MOs

Info

ID:	372869
PubChem CID:	131306295
Reduced:	BrO2H9C10 (1)
Stoich.:	AB2C9D10 (1)
Weight, g/mol:	173.105193
ΔH_f, kcal/mol:	-66.54
Dipole, Da:	3.1
IP(EA), eV:	-9.3(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3S)-3-hydroxy-1-methylpiperidine-4-carboxylate

Drug info:

PubChemData

Smile

C1CC2=C(CC1=O)C(=C(C=C2)Br)O

DOS

IR

Vibrations