Geometry & MOs

Info

ID:	333645
PubChem CID:	127252197
Reduced:	OF3N3H22C23 (1)
Stoich.:	AB3C3D22E23 (1)
Weight, g/mol:	379.14514
ΔH_f, kcal/mol:	-117.52
Dipole, Da:	2.49
IP(EA), eV:	-9.05(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-[(2-chlorophenyl)methyl]pyridin-2-yl]-4-(pyridin-3-ylmethyl)morpholine

Drug info:

PubChemData

Smile

C1COC(CN1CC2=CN=CC=C2)C3=CC=CC(=N3)CC4=CC=CC=C4C(F)(F)F

DOS

IR

Vibrations