Geometry & MOs

Info

ID:	173706
PubChem CID:	75671974
Reduced:	ClSN2O3C19H20 (1)
Stoich.:	ABC2D3E19F20 (1)
Weight, g/mol:	405.103966
ΔH_f, kcal/mol:	-46.45
Dipole, Da:	2.23
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.108403
Charge, e:	-1

Chem-info

IUPAC name:

(4-chlorophenyl)-[4-(3,5-dimethylpiperidine-1-carbonyl)phenyl]sulfonylazanide

Drug info:

PubChemData

Smile

CCCCNC(=O)C=CC1=CC=C(C=C1)S(=O)(=O)[N-]C2=CC=CC=C2Cl

DOS

IR

Vibrations