Geometry & MOs

Info

ID:	426840
PubChem CID:	135154109
Reduced:	O2N6C27H28 (1)
Stoich.:	A2B6C27D28 (1)
Weight, g/mol:	314.174276
ΔH_f, kcal/mol:	36.34
Dipole, Da:	8.94
IP(EA), eV:	-9.06(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(6-methoxypyridin-3-yl)oxypiperidin-1-yl]-5,6-dimethylpyrimidine

Drug info:

PubChemData

Smile

CC1=CC(=NN=C1N2CCC(CC2)OC3=CC=CC(=C3)C#N)C(=O)N[C@H]4CCC5=C(C4)N=CC=C5

DOS

IR

Vibrations