Geometry & MOs

Info

ID:	303998
PubChem CID:	124491212
Reduced:	NO2C8H15 (1)
Stoich.:	AB2C8D15 (1)
Weight, g/mol:	226.168128
ΔH_f, kcal/mol:	-107.47
Dipole, Da:	5.64
IP(EA), eV:	-9.42(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-morpholin-4-yl-3-[(2S)-pyrrolidin-2-yl]butan-1-one

Drug info:

PubChemData

Smile

C[C@H](CC(=O)O)[C@@H]1CCCN1

DOS

IR

Vibrations