Geometry & MOs

Info

ID:	402017
PubChem CID:	135053879
Reduced:	Cl2H18C23 (1)
Stoich.:	A2B18C23 (1)
Weight, g/mol:	348.108106
ΔH_f, kcal/mol:	61.31
Dipole, Da:	2.42
IP(EA), eV:	-9.13(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-4-[(3S,4R)-4-(4-fluorophenyl)-3-phenylcyclopenten-1-yl]benzene

Drug info:

PubChemData

Smile

C1[C@H]([C@H](C=C1C2=CC=C(C=C2)Cl)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations