Geometry & MOs

Info

ID:	127566
PubChem CID:	51006202
Reduced:	NO5C22H25 (1)
Stoich.:	AB5C22D25 (1)
Weight, g/mol:	280.086622
ΔH_f, kcal/mol:	-177.0
Dipole, Da:	2.74
IP(EA), eV:	-8.74(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1'R,9'R,12'R)-5'-chlorospiro[1,3-dioxolane-2,13'-tricyclo[7.3.1.02,7]trideca-2(7),3,5-triene]-12'-ol

Drug info:

PubChemData

Smile

CN1[C@@H]2CC[C@@H]1C(C(=O)C2CC3=CC(=C(C=C3)O)O)CC4=CC(=C(C=C4)O)O

DOS

IR

Vibrations