Geometry & MOs

Info

ID:	34451
PubChem CID:	7978482
Reduced:	ClFN4O4C18H20 (1)
Stoich.:	ABC4D4E18F20 (1)
Weight, g/mol:	353.137556
ΔH_f, kcal/mol:	-180.37
Dipole, Da:	5.82
IP(EA), eV:	-8.98(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(4-cyanophenoxy)acetyl]-4-propan-2-yloxybenzohydrazide

Drug info:

PubChemData

Smile

CCCCN1C(=C(C(=N1)C)C(=O)OCC(=O)NC(=O)NC2=CC=CC=C2F)Cl

DOS

IR

Vibrations