Geometry & MOs

Info

ID:	142608
PubChem CID:	53066241
Reduced:	N4O5H24C25 (1)
Stoich.:	A4B5C24D25 (1)
Weight, g/mol:	393.081698
ΔH_f, kcal/mol:	-113.3
Dipole, Da:	4.42
IP(EA), eV:	-8.41(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-acetamidophenyl)-5-pyrrolidin-1-ylsulfonylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1CC2=CC=CC=C2N1C(=O)C3=NN(C(=O)C=C3)CCC(=O)NC4=CC5=C(C=C4)OCCO5

DOS

IR

Vibrations