Geometry & MOs

Info

ID:	200554
PubChem CID:	79410519
Reduced:	N2O3C9H18 (1)
Stoich.:	A2B3C9D18 (1)
Weight, g/mol:	281.162708
ΔH_f, kcal/mol:	-143.06
Dipole, Da:	4.27
IP(EA), eV:	-9.25(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4S)-1-[2-(4-propoxyphenoxy)ethyl]pyrrolidine-3,4-diol

Drug info:

PubChemData

Smile

CCN(C)C(=O)CN1C[C@H]([C@H](C1)O)O

DOS

IR

Vibrations