Geometry & MOs

Info

ID:	142052
PubChem CID:	52973462
Reduced:	O3N5C20H23 (1)
Stoich.:	A3B5C20D23 (1)
Weight, g/mol:	388.120526
ΔH_f, kcal/mol:	-43.43
Dipole, Da:	5.96
IP(EA), eV:	-8.94(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-methylsulfonylbenzoyl)-5-phenylpyrazolidine-3-carbohydrazide

Drug info:

PubChemData

Smile

C1C(NNC1C(=O)NNC(=O)CCNC(=O)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations