Geometry & MOs

Info

ID:	29342
PubChem CID:	833174
Reduced:	N3O4H15C16 (1)
Stoich.:	A3B4C15D16 (1)
Weight, g/mol:	345.91784
ΔH_f, kcal/mol:	-46.8
Dipole, Da:	4.51
IP(EA), eV:	-8.81(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C([C@@H](NC(=O)N1)C2=C(C=CC3=CC=CC=C32)OC)[N+](=O)[O-]

DOS

IR

Vibrations