Geometry & MOs

Info

ID:	249410
PubChem CID:	103089240
Reduced:	FSCl2N2O2C13H17 (1)
Stoich.:	ABC2D2E2F13G17 (1)
Weight, g/mol:	340.021532
ΔH_f, kcal/mol:	-128.5
Dipole, Da:	4.68
IP(EA), eV:	-9.09(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,2R)-2-aminocyclohexyl]-2,4-dichloro-3-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CC1CCN(CC1CN)S(=O)(=O)C2=C(C(=C(C=C2)Cl)F)Cl

DOS

IR

Vibrations