Geometry & MOs

Info

ID:	387928
PubChem CID:	134987434
Reduced:	OC10H14 (1)
Stoich.:	AB10C14 (1)
Weight, g/mol:	196.14633
ΔH_f, kcal/mol:	-48.17
Dipole, Da:	4.2
IP(EA), eV:	-9.4(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-hydroxyspiro[4.7]dodecan-12-one

Drug info:

PubChemData

Smile

CC1=C[C@@H]2CC[C@]1(CC2=O)C

DOS

IR

Vibrations