Geometry & MOs

Info

ID:	306869
PubChem CID:	125264133
Reduced:	FN2O2C18H25 (1)
Stoich.:	AB2C2D18E25 (1)
Weight, g/mol:	320.190006
ΔH_f, kcal/mol:	-104.36
Dipole, Da:	3.5
IP(EA), eV:	-9.0(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,3aR,7aR)-1-[(3-fluorophenyl)methyl]-3-morpholin-4-yl-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrole

Drug info:

PubChemData

Smile

C1C[C@H]2[C@@H]([C@H](CN2CC3=CC(=CC=C3)F)N4CCOCC4)OC1

DOS

IR

Vibrations