Geometry & MOs

Info

ID:	193329
PubChem CID:	78376303
Reduced:	OSF3N4H11C12 (1)
Stoich.:	ABC3D4E11F12 (1)
Weight, g/mol:	430.10044
ΔH_f, kcal/mol:	-105.63
Dipole, Da:	7.21
IP(EA), eV:	-9.0(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[1-(4-bromophenyl)ethenyl]-5-(4-ethoxyphenyl)pyrazolidine-3-carbohydrazide

Drug info:

PubChemData

Smile

CC1C(=O)N(C(=S)NN1)N=CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations