Geometry & MOs

Info

ID:	76990
PubChem CID:	48425673
Reduced:	FSO2N3C18H22 (1)
Stoich.:	ABC2D3E18F22 (1)
Weight, g/mol:	409.04596
ΔH_f, kcal/mol:	-106.25
Dipole, Da:	5.33
IP(EA), eV:	-8.98(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-N-[2-(diethylamino)-2-oxoethyl]acetamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CC1=C(N=C(S1)C)C2=CC=C(C=C2)F

DOS

IR

Vibrations