Geometry & MOs

Info

ID:	331874
PubChem CID:	127250160
Reduced:	FON4H19C20 (1)
Stoich.:	ABC4D19E20 (1)
Weight, g/mol:	350.154289
ΔH_f, kcal/mol:	10.42
Dipole, Da:	3.86
IP(EA), eV:	-8.78(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[(4-fluorophenyl)methyl]pyridin-2-yl]-4-pyrimidin-2-ylmorpholine

Drug info:

PubChemData

Smile

C1COC(CN1C2=NC=CC=N2)C3=NC=C(C=C3)CC4=CC=CC=C4F

DOS

IR

Vibrations