Geometry & MOs

Info

ID:	65260
PubChem CID:	29204680
Reduced:	Cl2N3O4C18H21 (1)
Stoich.:	A2B3C4D18E21 (1)
Weight, g/mol:	474.122546
ΔH_f, kcal/mol:	-111.49
Dipole, Da:	2.91
IP(EA), eV:	-8.99(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,4-dichlorophenoxy)-N'-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetyl]butanehydrazide

Drug info:

PubChemData

Smile

CC1=NOC(=C1C(=O)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)C(C)C

DOS

IR

Vibrations