Geometry & MOs

Info

ID:	157178
PubChem CID:	56422227
Reduced:	N4O5H22C26 (1)
Stoich.:	A4B5C22D26 (1)
Weight, g/mol:	434.05486
ΔH_f, kcal/mol:	-94.18
Dipole, Da:	8.8
IP(EA), eV:	-8.97(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,5-dichloroanilino)-2-oxoethyl] 3-(1H-indazole-3-carbonylamino)propanoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)COC(=O)CCNC(=O)C3=NNC4=CC=CC=C43

DOS

IR

Vibrations