Geometry & MOs

Info

ID:	271127
PubChem CID:	103644438
Reduced:	SO3N4C12H20 (1)
Stoich.:	AB3C4D12E20 (1)
Weight, g/mol:	296.128469
ΔH_f, kcal/mol:	-117.68
Dipole, Da:	6.0
IP(EA), eV:	-9.47(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-fluoro-N-(1-methylpiperidin-4-yl)-3-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1)C)S(=O)(=O)N2CCCC(C2)C(=O)NC

DOS

IR

Vibrations