Geometry & MOs

Info

ID:	195869
PubChem CID:	78744501
Reduced:	NO3C11H13 (2)
Stoich.:	AB3C11D13 (2)
Weight, g/mol:	405.115855
ΔH_f, kcal/mol:	-242.8
Dipole, Da:	7.41
IP(EA), eV:	-8.69(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-carbamoylpiperidin-1-yl)-2-oxoethyl] 2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC(=CC=C1)OC)OC(=O)C2=CC=C(C=C2)NC(=O)OC(C)(C)C

DOS

IR

Vibrations