Geometry & MOs

Info

ID:	402755
PubChem CID:	135057140
Reduced:	ClFOC9H10 (1)
Stoich.:	ABCD9E10 (1)
Weight, g/mol:	180.11503
ΔH_f, kcal/mol:	-87.35
Dipole, Da:	2.6
IP(EA), eV:	-9.93(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6R)-6-propyl-3,4,5,6-tetrahydro-2H-cyclopenta[b]pyran-7-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@H]([C@@H](CCl)O)F

DOS

IR

Vibrations