Geometry & MOs

Info

ID:	305875
PubChem CID:	124972228
Reduced:	ON4C20H30 (1)
Stoich.:	AB4C20D30 (1)
Weight, g/mol:	326.221895
ΔH_f, kcal/mol:	-3.38
Dipole, Da:	3.71
IP(EA), eV:	-7.92(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(3S)-1-(4,6-dimethylpyrimidin-2-yl)piperidin-3-yl]methyl]-N,N-dimethylpyrazin-2-amine

Drug info:

PubChemData

Smile

C[C@@]1(CCCN(C1)C2CCOCC2)C3=CN4C=CC=C4C(=N3)N(C)C

DOS

IR

Vibrations