Geometry & MOs

Info

ID:	372166
PubChem CID:	131294070
Reduced:	ON4H8C10 (1)
Stoich.:	AB4C8D10 (1)
Weight, g/mol:	200.069811
ΔH_f, kcal/mol:	62.9
Dipole, Da:	4.57
IP(EA), eV:	-9.62(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-6-methoxycinnoline-3-carbonitrile

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)O)N2C=NC(=N2)CC#N

DOS

IR

Vibrations