Geometry & MOs

Info

ID:	32051
PubChem CID:	4254369
Reduced:	ClON2S2H17C20 (1)
Stoich.:	ABC2D2E17F20 (1)
Weight, g/mol:	327.078996
ΔH_f, kcal/mol:	34.87
Dipole, Da:	2.65
IP(EA), eV:	-8.67(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-pyrimidin-2-ylacetamide

Drug info:

PubChemData

Smile

C1CN(CC2=CC=CC=C21)C(=O)CSC3=NC(=CS3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations