Geometry & MOs

Info

ID:	305715
PubChem CID:	124966247
Reduced:	FON3C23H28 (1)
Stoich.:	ABC3D23E28 (1)
Weight, g/mol:	409.18017
ΔH_f, kcal/mol:	-43.98
Dipole, Da:	3.97
IP(EA), eV:	-8.5(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-3-[5-[(2-fluorophenyl)methyl]-1,3-oxazol-2-yl]-3-methylpiperidin-1-yl]-(2-methoxypyridin-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)[C@H]2CCCN(C2)CC3=CCCOC3)NC4=CC=C(C=C4)F

DOS

IR

Vibrations