Geometry & MOs

Info

ID:	173396
PubChem CID:	75633406
Reduced:	N2O2C12H13 (2)
Stoich.:	A2B2C12D13 (2)
Weight, g/mol:	379.13322
ΔH_f, kcal/mol:	-82.91
Dipole, Da:	2.0
IP(EA), eV:	-8.81(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

1-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-4-(5-fluoro-2-methylphenyl)pyrazine-1,4-diium-2,3-dione

Drug info:

PubChemData

Smile

CN1C=C(C2C1C(=O)N(C(=O)N2CC(=O)NCC3=CC=C(C=C3)OC)C)C4=CC=CC=C4

DOS

IR

Vibrations