Geometry & MOs

Info

ID:	145007
PubChem CID:	53447894
Reduced:	OCl2N4H16C17 (1)
Stoich.:	AB2C4D16E17 (1)
Weight, g/mol:	357.064697
ΔH_f, kcal/mol:	41.77
Dipole, Da:	4.04
IP(EA), eV:	-8.84(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dichloro-3-[2-(3,5-dimethylpyrazolidin-4-yl)-2-oxoethyl]-3-hydroxy-1H-indol-2-one

Drug info:

PubChemData

Smile

C1C(NNC1C(=O)NN=CC2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3

DOS

IR

Vibrations