Geometry & MOs

Info

ID:	383817
PubChem CID:	134975760
Reduced:	OC13H20 (1)
Stoich.:	AB13C20 (1)
Weight, g/mol:	184.14633
ΔH_f, kcal/mol:	-46.59
Dipole, Da:	3.08
IP(EA), eV:	-9.2(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,3S)-4-hexylcyclopent-4-ene-1,3-diol

Drug info:

PubChemData

Smile

CC(=CC[C@@H]1[C@@H](CCC1=O)CC=C)C

DOS

IR

Vibrations