Geometry & MOs

Info

ID:	306875
PubChem CID:	125264151
Reduced:	NO2C9H16 (2)
Stoich.:	AB2C9D16 (2)
Weight, g/mol:	340.236208
ΔH_f, kcal/mol:	-172.31
Dipole, Da:	1.48
IP(EA), eV:	-8.85(1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,5S,7aR)-5-(2-morpholin-4-ylethoxymethyl)-1-[(3R)-oxolan-3-yl]-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrole

Drug info:

PubChemData

Smile

C1C[C@@H]2[C@H](CCN2[C@H]3CCOC3)O[C@@H]1COCCN4CCOCC4

DOS

IR

Vibrations