Geometry & MOs

Info

ID:	378443
PubChem CID:	134224524
Reduced:	O2C13H24 (1)
Stoich.:	A2B13C24 (1)
Weight, g/mol:	175.120843
ΔH_f, kcal/mol:	-136.48
Dipole, Da:	2.24
IP(EA), eV:	-10.61(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S,4S,5R)-2-(hydroxymethyl)-5-propylpyrrolidine-3,4-diol

Drug info:

PubChemData

Smile

CC(CC1CCCCC1)CC(C)OC=O

DOS

IR

Vibrations