Geometry & MOs

Info

ID:	19832
PubChem CID:	573618
Reduced:	BrClOSC14H16 (1)
Stoich.:	ABCDE14F16 (1)
Weight, g/mol:	345.97938
ΔH_f, kcal/mol:	-24.3
Dipole, Da:	2.2
IP(EA), eV:	-8.76(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-bromo-2-phenylsulfanylcyclopropyl)-2-chlorocyclopentan-1-ol

Drug info:

PubChemData

Smile

C1CC(C(C1)(C2(CC2SC3=CC=CC=C3)Br)O)Cl

DOS

IR

Vibrations