Geometry & MOs

Info

ID:	347355
PubChem CID:	127272204
Reduced:	S2N3O3C18H21 (1)
Stoich.:	A2B3C3D18E21 (1)
Weight, g/mol:	322.092204
ΔH_f, kcal/mol:	-80.22
Dipole, Da:	3.8
IP(EA), eV:	-9.34(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCC1C2=NC=CS2)C(=O)NC3CCS(=O)(=O)C4=CC=CC=C34

DOS

IR

Vibrations