Geometry & MOs

Info

ID:	34462
PubChem CID:	7978493
Reduced:	ClSO3N4C16H17 (1)
Stoich.:	ABC3D4E16F17 (1)
Weight, g/mol:	377.098726
ΔH_f, kcal/mol:	-51.25
Dipole, Da:	7.98
IP(EA), eV:	-9.31(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(4-cyanophenoxy)acetyl]-2-[3-(trifluoromethyl)phenyl]acetohydrazide

Drug info:

PubChemData

Smile

CCCCN1C(=C(C(=N1)C)C(=O)OCC(=O)NC2=C(C=CS2)C#N)Cl

DOS

IR

Vibrations