Geometry & MOs

Info

ID:	363317
PubChem CID:	127310829
Reduced:	ON5C19H29 (1)
Stoich.:	AB5C19D29 (1)
Weight, g/mol:	388.204531
ΔH_f, kcal/mol:	2.05
Dipole, Da:	1.58
IP(EA), eV:	-8.52(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]-2-(1-methylpyrazol-4-yl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CN1CCC(CC1)N2CCC(CC2)NC(=O)C3=NC(=NC=C3)C4CC4

DOS

IR

Vibrations