Geometry & MOs

Info

ID:	279076
PubChem CID:	103840943
Reduced:	NO3C10H13 (1)
Stoich.:	AB3C10D13 (1)
Weight, g/mol:	212.152478
ΔH_f, kcal/mol:	-101.78
Dipole, Da:	6.54
IP(EA), eV:	-10.06(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(hydroxymethyl)piperidin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone

Drug info:

PubChemData

Smile

C#CCCC(=O)N1CCC[C@@H]1C(=O)O

DOS

IR

Vibrations