Geometry & MOs

Info

ID:	187691
PubChem CID:	77610920
Reduced:	O2C17H25 (2)
Stoich.:	A2B17C25 (2)
Weight, g/mol:	521.232599
ΔH_f, kcal/mol:	-222.28
Dipole, Da:	5.85
IP(EA), eV:	-10.08(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(3-fluoro-2-methylphenyl)-5-(5-methoxypyridine-3-carbonyl)piperidin-3-yl]-2-methoxy-1-(5-methoxypyridin-3-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(C)CCCC(C)C1CCC2C1(CCC3C2C(CC4C3(C(CC(=O)C4)OC(=O)C5=CC=CC=C5)C)O)C

DOS

IR

Vibrations