Geometry & MOs

Info

ID:	77026
PubChem CID:	48425722
Reduced:	NO2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	379.136591
ΔH_f, kcal/mol:	-142.94
Dipole, Da:	4.4
IP(EA), eV:	-8.42(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-2-[[2-[4-(4-fluorophenyl)-5-methyl-2-oxo-1,3-thiazol-3-yl]acetyl]amino]acetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=CC2=C(C(=CC=C2)OCC)OC1

DOS

IR

Vibrations