Geometry & MOs

Info

ID:	398850
PubChem CID:	135035761
Reduced:	OF7H10C17 (2)
Stoich.:	AB7C10D17 (2)
Weight, g/mol:	265.204179
ΔH_f, kcal/mol:	-679.79
Dipole, Da:	9.12
IP(EA), eV:	-9.09(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-13-hydroxy-6-methyl-17-oxa-13-azatetracyclo[12.2.1.01,9.04,9]heptadecane

Drug info:

PubChemData

Smile

C1CCC2=C(C(=C(C=C2C1)C3=C(C(=C(C(=C3F)F)C(F)(F)F)F)F)O)C4C([C@@H](CC5=CC=CC=C45)C6=C(C(=C(C(=C6F)F)C(F)(F)F)F)F)O

DOS

IR

Vibrations