Geometry & MOs

Info

ID:	176191
PubChem CID:	76007477
Reduced:	NS2O3C17H19 (1)
Stoich.:	AB2C3D17E19 (1)
Weight, g/mol:	364.068664
ΔH_f, kcal/mol:	-75.88
Dipole, Da:	6.82
IP(EA), eV:	-9.33(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

1-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-2-phenylethanamine;chloride

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)CS

DOS

IR

Vibrations