Geometry & MOs

Info

ID:	349511
PubChem CID:	127275398
Reduced:	OSN4C12H16 (1)
Stoich.:	ABC4D12E16 (1)
Weight, g/mol:	363.172896
ΔH_f, kcal/mol:	0.8
Dipole, Da:	3.97
IP(EA), eV:	-8.9(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)NC(=O)N2CCC(CC2)C#N)C

DOS

IR

Vibrations