Geometry & MOs

Info

ID:	305612
PubChem CID:	124962208
Reduced:	O2N4C9H12 (1)
Stoich.:	A2B4C9D12 (1)
Weight, g/mol:	352.169939
ΔH_f, kcal/mol:	-51.39
Dipole, Da:	2.72
IP(EA), eV:	-9.55(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3-fluorophenyl)methyl]-2-[(3S)-1-(2-methylpyrimidin-4-yl)piperidin-3-yl]-1,3-oxazole

Drug info:

PubChemData

Smile

C1CN(C[C@@H]1O)C(=O)C2=CN=CN=C2N

DOS

IR

Vibrations