Geometry & MOs

Info

ID:	142984
PubChem CID:	53127183
Reduced:	N3O4H19C20 (1)
Stoich.:	A3B4C19D20 (1)
Weight, g/mol:	432.092597
ΔH_f, kcal/mol:	-40.18
Dipole, Da:	3.66
IP(EA), eV:	-8.85(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methylphenyl)methyl]-4-[5-(pyrrolidine-1-carbonyl)-1,3,4-oxadiazol-2-yl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CCCN1C(=O)COC2=C1C=C(C=C2)C3=NOC(=N3)COC4=CC=CC=C4

DOS

IR

Vibrations