Geometry & MOs

Info

ID:	128844
PubChem CID:	51060469
Reduced:	FN3O5H22C25 (1)
Stoich.:	AB3C5D22E25 (1)
Weight, g/mol:	313.106256
ΔH_f, kcal/mol:	-141.47
Dipole, Da:	5.5
IP(EA), eV:	-9.11(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(Z)-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-N-(4-methylphenyl)-2-oxoacetamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2/C=N/NC(=O)CNC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations