Geometry & MOs

Info

ID:	51771
PubChem CID:	12014508
Reduced:	OSC18H22 (1)
Stoich.:	ABC18D22 (1)
Weight, g/mol:	270.16198
ΔH_f, kcal/mol:	-45.91
Dipole, Da:	1.05
IP(EA), eV:	-8.78(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-phenylspiro[1,3-dioxolane-2,2'-adamantane]

Drug info:

PubChemData

Smile

C1[C@H](OC2(S1)C3CC4CC(C3)CC2C4)C5=CC=CC=C5

DOS

IR

Vibrations