Geometry & MOs

Info

ID:	306270
PubChem CID:	125003426
Reduced:	ON5C14H19 (1)
Stoich.:	AB5C14D19 (1)
Weight, g/mol:	316.135782
ΔH_f, kcal/mol:	41.72
Dipole, Da:	2.35
IP(EA), eV:	-9.43(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-3-[2-(dimethylamino)pyridin-4-yl]piperidin-1-yl]-(1,3-thiazol-5-yl)methanone

Drug info:

PubChemData

Smile

COCCN1CCC[C@@H]1C2=NC=CN=C2C3=CC=NN3

DOS

IR

Vibrations