Geometry & MOs

Info

ID:	73841
PubChem CID:	48420667
Reduced:	N3O3H21C23 (1)
Stoich.:	A3B3C21D23 (1)
Weight, g/mol:	399.158292
ΔH_f, kcal/mol:	-25.78
Dipole, Da:	6.3
IP(EA), eV:	-9.32(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[phenyl(pyridin-4-yl)methyl] 4-(5-phenyl-1,3,4-oxadiazol-2-yl)butanoate

Drug info:

PubChemData

Smile

C1CC1NC(=O)NC2=CC=C(C=C2)C(=O)OC(C3=CC=CC=C3)C4=CC=NC=C4

DOS

IR

Vibrations