Geometry & MOs

Info

ID:	191486
PubChem CID:	78152022
Reduced:	Cl2O3N5C43H43 (1)
Stoich.:	A2B3C5D43E43 (1)
Weight, g/mol:	350.104876
ΔH_f, kcal/mol:	-41.76
Dipole, Da:	12.26
IP(EA), eV:	-8.17(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(furan-2-yl)-N-[(4-sulfamoylphenyl)methyl]pyrazolidine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C=CC2=C1C=CC(=C2)N(C3=CC=C(C=C3)O)C(=O)C4=C5CCCCN5C(=C4)C6=CC=CC=C6C(=O)N7CC8=C(CC7CN(C)C)C(=CC=C8)Cl.Cl

DOS

IR

Vibrations