Geometry & MOs

Info

ID:	404706
PubChem CID:	135069730
Reduced:	ON2F4H8C14 (1)
Stoich.:	AB2C4D8E14 (1)
Weight, g/mol:	170.13068
ΔH_f, kcal/mol:	-184.56
Dipole, Da:	6.74
IP(EA), eV:	-8.79(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5R)-spiro[4.5]decane-4,10-diol

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1C(F)(F)F)N/C(=C\3/C=CC(=CC3=O)F)/N2

DOS

IR

Vibrations