Geometry & MOs

Info

ID:	41815
PubChem CID:	8147153
Reduced:	ON3C24H31 (1)
Stoich.:	AB3C24D31 (1)
Weight, g/mol:	387.120604
ΔH_f, kcal/mol:	-18.29
Dipole, Da:	7.73
IP(EA), eV:	-9.06(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N'-(2,3,5,6-tetrafluorophenyl)propanehydrazide

Drug info:

PubChemData

Smile

C[C@@H](C1=NC(=O)C2=CC=CC=C2N1)N[C@@H](C3=CC=C(C=C3)CC(C)C)C(C)C

DOS

IR

Vibrations