Geometry & MOs

Info

ID:	34486
PubChem CID:	7978531
Reduced:	ClN4O4H17C19 (1)
Stoich.:	AB4C4D17E19 (1)
Weight, g/mol:	381.168856
ΔH_f, kcal/mol:	-71.83
Dipole, Da:	7.35
IP(EA), eV:	-9.7(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyanophenoxy)-N'-[2-(3-methyl-4-propan-2-ylphenoxy)acetyl]acetohydrazide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NCCC(=O)NNC(=O)COC2=CC=C(C=C2)C#N)Cl

DOS

IR

Vibrations