Geometry & MOs

Info

ID:	378451
PubChem CID:	134224533
Reduced:	O2C7H14 (1)
Stoich.:	A2B7C14 (1)
Weight, g/mol:	159.125929
ΔH_f, kcal/mol:	-121.34
Dipole, Da:	3.3
IP(EA), eV:	-10.36(2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R,5R)-2-(hydroxymethyl)-5-propylpyrrolidin-3-ol

Drug info:

PubChemData

Smile

CC[C@@H]1C[C@@H](OC1O)C

DOS

IR

Vibrations