Geometry & MOs

Info

ID:	157328
PubChem CID:	56422886
Reduced:	ClO4N6H21C23 (1)
Stoich.:	AB4C6D21E23 (1)
Weight, g/mol:	437.149932
ΔH_f, kcal/mol:	-47.76
Dipole, Da:	8.76
IP(EA), eV:	-9.38(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl 3-(1H-indazole-3-carbonylamino)propanoate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CN2C(=CC=N2)NC(=O)COC(=O)CCNC(=O)C3=NNC4=CC=CC=C43)Cl

DOS

IR

Vibrations