Geometry & MOs

Info

ID:	1417
PubChem CID:	4381
Reduced:	NO4C7H15 (1)
Stoich.:	AB4C7D15 (1)
Weight, g/mol:	177.100108
ΔH_f, kcal/mol:	-187.8
Dipole, Da:	5.49
IP(EA), eV:	-9.29(1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(hydroxymethyl)-1-methylpiperidine-3,4,5-triol

Drug info:

PubChemData

Smile

CN1CC(C(C(C1CO)O)O)O

DOS

IR

Vibrations