Geometry & MOs

Info

ID:	142066
PubChem CID:	52975650
Reduced:	SO2N5C18H19 (1)
Stoich.:	AB2C5D18E19 (1)
Weight, g/mol:	376.110232
ΔH_f, kcal/mol:	16.15
Dipole, Da:	0.93
IP(EA), eV:	-9.1(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-acetamido-3-chlorophenyl)-3-(4-fluorophenyl)pyrazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC2=C(S1)N=CN(C2=O)NC(=O)C3CC(NN3)C4=CC=CC=C4

DOS

IR

Vibrations