Geometry & MOs

Info

ID:	34444
PubChem CID:	7978474
Reduced:	ClO3N4C18H19 (1)
Stoich.:	AB3C4D18E19 (1)
Weight, g/mol:	323.126991
ΔH_f, kcal/mol:	-31.98
Dipole, Da:	2.41
IP(EA), eV:	-9.59(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(4-cyanophenoxy)acetyl]-2,5-dimethylbenzohydrazide

Drug info:

PubChemData

Smile

CCCCN1C(=C(C(=N1)C)C(=O)OCC2=NN=C(O2)C3=CC=CC=C3)Cl

DOS

IR

Vibrations