Geometry & MOs

Info

ID:	151876
PubChem CID:	56310699
Reduced:	Cl2N2S2O3C16H18 (1)
Stoich.:	A2B2C2D3E16F18 (1)
Weight, g/mol:	423.128649
ΔH_f, kcal/mol:	-59.82
Dipole, Da:	3.93
IP(EA), eV:	-7.84(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methylsulfamoyl]thiophen-2-yl]methyl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CCC(C2)CNS(=O)(=O)C3=C(SC(=C3)Cl)Cl

DOS

IR

Vibrations