Geometry & MOs

Info

ID:	153677
PubChem CID:	56312968
Reduced:	NSO2C11H12 (2)
Stoich.:	ABC2D11E12 (2)
Weight, g/mol:	435.140591
ΔH_f, kcal/mol:	-90.02
Dipole, Da:	8.99
IP(EA), eV:	-8.49(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1CN(C)C(=O)C2=C(C=CS2)S(=O)(=O)NC3=CC=C(C=C3)C

DOS

IR

Vibrations