Geometry & MOs

Info

ID:	253618
PubChem CID:	103119601
Reduced:	ON2H6C7 (2)
Stoich.:	AB2C6D7 (2)
Weight, g/mol:	254.080376
ΔH_f, kcal/mol:	24.77
Dipole, Da:	3.39
IP(EA), eV:	-8.65(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C1=CC=C(C=C1)O)C(=O)C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations