Geometry & MOs

Info

ID:	331861
PubChem CID:	127250147
Reduced:	O2F3N4H19C22 (1)
Stoich.:	A2B3C4D19E22 (1)
Weight, g/mol:	406.205656
ΔH_f, kcal/mol:	-139.54
Dipole, Da:	2.82
IP(EA), eV:	-9.43(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[(4-fluorophenyl)methyl]pyridin-2-yl]-4-[2-(4-methoxyphenyl)ethyl]morpholine

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)C2=NC=CN=C2)C3=NC=C(C=C3)CC4=CC(=CC=C4)C(F)(F)F

DOS

IR

Vibrations