Geometry & MOs

Info

ID:	58332
PubChem CID:	24697820
Reduced:	BrSN2O2H11C12 (1)
Stoich.:	ABC2D2E11F12 (1)
Weight, g/mol:	249.164126
ΔH_f, kcal/mol:	-23.29
Dipole, Da:	2.69
IP(EA), eV:	-8.55(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-4-[(4-methylpiperidin-1-yl)methyl]benzenecarboximidamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)N)NS(=O)(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations