Geometry & MOs

Info

ID:	138922
PubChem CID:	52443592
Reduced:	ClFO2N3C22H23 (1)
Stoich.:	ABC2D3E22F23 (1)
Weight, g/mol:	405.98248
ΔH_f, kcal/mol:	-92.98
Dipole, Da:	8.42
IP(EA), eV:	-8.97(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-4-[(Z)-C-methyl-N-[(3,5,6-trichloropyridin-2-yl)amino]carbonimidoyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N2CCN(CC2)C(=O)[C@@H]3CC(=O)N(C3)C4=CC(=C(C=C4)F)Cl

DOS

IR

Vibrations