Geometry & MOs

Info

ID:	137768
PubChem CID:	52259479
Reduced:	FN2O4H9C14 (1)
Stoich.:	AB2C4D9E14 (1)
Weight, g/mol:	415.98417
ΔH_f, kcal/mol:	-40.7
Dipole, Da:	6.89
IP(EA), eV:	-9.92(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromothiophen-2-yl)methyl]-N-ethyl-2-(2-fluoro-4-nitrophenoxy)acetamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(O2)COC3=C(C=C(C=C3)[N+](=O)[O-])F

DOS

IR

Vibrations