Geometry & MOs

Info

ID:	157323
PubChem CID:	56422880
Reduced:	N5O5C21H21 (1)
Stoich.:	A5B5C21D21 (1)
Weight, g/mol:	460.154683
ΔH_f, kcal/mol:	-132.65
Dipole, Da:	6.17
IP(EA), eV:	-9.3(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-fluoroanilino)-2-oxo-1-phenylethyl] 3-(1H-indazole-3-carbonylamino)propanoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNC(=O)NC(=O)COC(=O)CCNC(=O)C2=NNC3=CC=CC=C32

DOS

IR

Vibrations