Geometry & MOs

Info

ID:	124531
PubChem CID:	50887148
Reduced:	NO2C19H23 (1)
Stoich.:	AB2C19D23 (1)
Weight, g/mol:	417.143704
ΔH_f, kcal/mol:	-58.28
Dipole, Da:	6.4
IP(EA), eV:	-7.9(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-5-[(4,5-dimethyl-2-nitrophenyl)hydrazinylidene]-4-methyl-2,6-dioxopyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N/C=C/2\C=C(C=C(C2=O)C(C)(C)C)C)O

DOS

IR

Vibrations