Geometry & MOs

Info

ID:	352384
PubChem CID:	127283471
Reduced:	NOC5H6 (4)
Stoich.:	ABC5D6 (4)
Weight, g/mol:	359.087453
ΔH_f, kcal/mol:	-131.22
Dipole, Da:	6.93
IP(EA), eV:	-8.88(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1-methylpyrazol-4-yl)-1,3-thiazol-4-yl]-[2-(1,3-thiazol-2-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)C(=O)C3=CC4=C(CCCC4=O)NC3=O)C

DOS

IR

Vibrations