Geometry & MOs

Info

ID:	78001
PubChem CID:	49681501
Reduced:	SN4O4H14C16 (1)
Stoich.:	AB4C4D14E16 (1)
Weight, g/mol:	344.057926
ΔH_f, kcal/mol:	-41.0
Dipole, Da:	6.86
IP(EA), eV:	-9.76(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methylsulfonyl-N-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)benzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations