Geometry & MOs

Info

ID:	151101
PubChem CID:	53790799
Reduced:	ON2H10C11 (1)
Stoich.:	AB2C10D11 (1)
Weight, g/mol:	211.081773
ΔH_f, kcal/mol:	55.5
Dipole, Da:	3.53
IP(EA), eV:	-9.27(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-diamino-N-(diaminomethylidene)-6-oxo-1H-pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC2=CC(=CC(=N)N=C2C=C1)CO

DOS

IR

Vibrations