Geometry & MOs

Info

ID:	124956
PubChem CID:	50905227
Reduced:	Cl2N2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	595.84548
ΔH_f, kcal/mol:	30.03
Dipole, Da:	2.05
IP(EA), eV:	-9.35(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,6aS)-2-(4-chlorophenyl)-5,5,6a-trimethyl-3,3a,4,6-tetrahydrocyclopenta[c]pyrazol-2-ium;hexachloroantimony(1-)

Drug info:

PubChemData

Smile

CC(C)(CC=C)CC(C)(N=NC1=CC=C(C=C1)Cl)Cl

DOS

IR

Vibrations