Geometry & MOs

Info

ID:	253625
PubChem CID:	103119633
Reduced:	ClO2N3H12C15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	288.041403
ΔH_f, kcal/mol:	-10.13
Dipole, Da:	8.38
IP(EA), eV:	-8.63(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)-1,5-dihydropyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3)Cl)O

DOS

IR

Vibrations