Geometry & MOs

Info

ID:	361085
PubChem CID:	127301975
Reduced:	O2N5C17H23 (1)
Stoich.:	A2B5C17D23 (1)
Weight, g/mol:	333.162332
ΔH_f, kcal/mol:	-29.6
Dipole, Da:	6.33
IP(EA), eV:	-8.71(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethylpiperidin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN1CCCCC1CNC(=O)CN2C(=O)C3=CC=CC=C3N=N2

DOS

IR

Vibrations