Geometry & MOs

Info

ID:	77031
PubChem CID:	48425728
Reduced:	BrN2O4C16H21 (1)
Stoich.:	AB2C4D16E21 (1)
Weight, g/mol:	323.076219
ΔH_f, kcal/mol:	-159.02
Dipole, Da:	2.28
IP(EA), eV:	-8.87(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-2-thiophen-3-yl-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CC1=CC2=C(C=C1Br)OCCO2

DOS

IR

Vibrations