Geometry & MOs

Info

ID:	34686
PubChem CID:	7978825
Reduced:	ClN4O4C19H27 (1)
Stoich.:	AB4C4D19E27 (1)
Weight, g/mol:	419.151492
ΔH_f, kcal/mol:	-154.34
Dipole, Da:	2.41
IP(EA), eV:	-9.25(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-[2-(3,5-dimethylphenoxy)acetyl]hydrazinyl]-2-oxoethyl]-N,4-dimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCCCN1C(=C(C(=N1)C)/C=C/C(=O)OCC(=O)N2CCC(CC2)C(=O)N)Cl

DOS

IR

Vibrations