Geometry & MOs

Info

ID:	340540
PubChem CID:	127262551
Reduced:	N2O2C11H12 (1)
Stoich.:	A2B2C11D12 (1)
Weight, g/mol:	282.050138
ΔH_f, kcal/mol:	-45.01
Dipole, Da:	3.21
IP(EA), eV:	-9.17(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(Z)-(4-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)amino]-1,4-dihydropyrazine-2,5-dicarbonitrile

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1=NC=C2C=CNC2=C1

DOS

IR

Vibrations