Geometry & MOs

Info

ID:	142049
PubChem CID:	52972478
Reduced:	Cl2N2O3C17H18 (1)
Stoich.:	A2B2C3D17E18 (1)
Weight, g/mol:	364.10054
ΔH_f, kcal/mol:	-105.05
Dipole, Da:	3.62
IP(EA), eV:	-9.13(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-fluorophenyl)sulfonyl-5-phenylpyrazolidine-3-carbohydrazide

Drug info:

PubChemData

Smile

COC1CCC2C(C1)C=C(C(=NC3=C(C=C(C=C3)Cl)Cl)O2)C(=O)N

DOS

IR

Vibrations