Geometry & MOs

Info

ID:	305662
PubChem CID:	124964421
Reduced:	ON2C10H16 (2)
Stoich.:	AB2C10D16 (2)
Weight, g/mol:	352.169939
ΔH_f, kcal/mol:	-106.32
Dipole, Da:	3.43
IP(EA), eV:	-9.24(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3-fluorophenyl)methyl]-2-[(3R)-1-(6-methylpyrimidin-4-yl)piperidin-3-yl]-1,3-oxazole

Drug info:

PubChemData

Smile

CCC(CC)C(=O)N1CC[C@@H](C1)C2=NC(=C(C(=N2)C)CC(=O)NCC)C

DOS

IR

Vibrations