Geometry & MOs

Info

ID:	152203
PubChem CID:	56311082
Reduced:	ClSN2O4C19H23 (1)
Stoich.:	ABC2D4E19F23 (1)
Weight, g/mol:	448.018197
ΔH_f, kcal/mol:	-115.22
Dipole, Da:	4.43
IP(EA), eV:	-7.82(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,6-trichloro-N-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)S(=O)(=O)NCC2CCN(C2)C3=CC=CC=C3OC)Cl

DOS

IR

Vibrations