Geometry & MOs

Info

ID:	78002
PubChem CID:	49681502
Reduced:	SN4O4H12C15 (1)
Stoich.:	AB4C4D12E15 (1)
Weight, g/mol:	340.099397
ΔH_f, kcal/mol:	-38.52
Dipole, Da:	6.22
IP(EA), eV:	-9.78(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenylsulfanyl-N-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)butanamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=NN=C(O2)C3=CC=NC=C3

DOS

IR

Vibrations