Geometry & MOs

Info

ID:	343271
PubChem CID:	127266444
Reduced:	ClOSN5C21H22 (1)
Stoich.:	ABCD5E21F22 (1)
Weight, g/mol:	285.111341
ΔH_f, kcal/mol:	73.41
Dipole, Da:	13.68
IP(EA), eV:	-8.54(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-anilino-N'-[(Z)-(5-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]acetohydrazide

Drug info:

PubChemData

Smile

CCN(CC)C1=CC=C(C=C1)C(=O)NN/C=C/2\C(=NC(=NC3=CC=CC=C3)S2)Cl

DOS

IR

Vibrations