Geometry & MOs

Info

ID:	38951
PubChem CID:	8138223
Reduced:	ClSO3N5H12C15 (1)
Stoich.:	ABC3D5E12F15 (1)
Weight, g/mol:	400.110436
ΔH_f, kcal/mol:	1.64
Dipole, Da:	3.1
IP(EA), eV:	-9.14(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2-(5-fluoro-2-nitrophenoxy)acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=NN=C(O2)SCC(=O)NNC(=O)C3=CC=CN3)Cl

DOS

IR

Vibrations