Geometry & MOs

Info

ID:	139314
PubChem CID:	52508376
Reduced:	SO2N4C18H18 (1)
Stoich.:	AB2C4D18E18 (1)
Weight, g/mol:	354.115047
ΔH_f, kcal/mol:	51.25
Dipole, Da:	4.12
IP(EA), eV:	-8.33(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[(1R)-1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]amino]phenyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C1=NC(=NO1)C2CC2)NC3=CC=C(C=C3)NC(=O)C4=CC=CS4

DOS

IR

Vibrations