Geometry & MOs

Info

ID:	124486
PubChem CID:	50884958
Reduced:	INO2H16C20 (1)
Stoich.:	ABC2D16E20 (1)
Weight, g/mol:	371.163377
ΔH_f, kcal/mol:	31.31
Dipole, Da:	1.91
IP(EA), eV:	-8.96(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hydroxy-4-methyl-2-oxo-5-[(N-phenylanilino)methyl]-1-prop-2-enylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)I)N=CC2=CC=C(O2)C3=CC=C(C=C3)C(=O)C

DOS

IR

Vibrations