Geometry & MOs

Info

ID:	196508
PubChem CID:	78839371
Reduced:	O2N3C18H23 (1)
Stoich.:	A2B3C18D23 (1)
Weight, g/mol:	432.140925
ΔH_f, kcal/mol:	-37.29
Dipole, Da:	2.25
IP(EA), eV:	-8.82(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N'-[2-(4-methylphenoxy)acetyl]-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbohydrazide

Drug info:

PubChemData

Smile

CC1=C(N=C(O1)C2=CC=CC=C2)CC(=O)N3CCCN(CC3)C

DOS

IR

Vibrations