Geometry & MOs

Info

ID:	10997
PubChem CID:	109779
Reduced:	Cl2O2N5H13C19 (1)
Stoich.:	A2B2C5D13E19 (1)
Weight, g/mol:	413.04463
ΔH_f, kcal/mol:	69.62
Dipole, Da:	4.45
IP(EA), eV:	-9.13(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-anilino-5-[(3,4-dichlorophenyl)diazenyl]-2-hydroxy-4-methyl-6-oxopyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=C(C(=O)N(C(=C1C#N)O)NC2=CC=CC=C2)N=NC3=CC(=C(C=C3)Cl)Cl

DOS

IR

Vibrations