Geometry & MOs

Info

ID:	226787
PubChem CID:	87558320
Reduced:	AlO2Br5F5H5C14 (1)
Stoich.:	AB2C5D5E5F14 (1)
Weight, g/mol:	344.120403
ΔH_f, kcal/mol:	-315.83
Dipole, Da:	1.94
IP(EA), eV:	-9.59(-1.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-chlorophenyl)-N'-(2-fluoroethyl)-4-phenyl-3,4-dihydropyrazole-2-carboximidamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC(C(Br)(Br)Br)([Al](OC2=C(C(=C(C(=C2F)F)F)F)F)Br)Br

DOS

IR

Vibrations