Geometry & MOs

Info

ID:	51770
PubChem CID:	12014507
Reduced:	OSC18H22 (1)
Stoich.:	ABC18D22 (1)
Weight, g/mol:	286.139137
ΔH_f, kcal/mol:	-48.93
Dipole, Da:	1.24
IP(EA), eV:	-8.76(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-phenylspiro[1,3-oxathiolane-2,2'-adamantane]

Drug info:

PubChemData

Smile

C1[C@@H](SC2(O1)C3CC4CC(C3)CC2C4)C5=CC=CC=C5

DOS

IR

Vibrations