Geometry & MOs

Info

ID:	323536
PubChem CID:	126675288
Reduced:	BrOC13H17 (1)
Stoich.:	ABC13D17 (1)
Weight, g/mol:	234.125594
ΔH_f, kcal/mol:	-39.69
Dipole, Da:	3.57
IP(EA), eV:	-9.38(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(9R)-9-phenylmethoxy-1,4-dioxaspiro[4.4]nonane

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)Br)OC2CCCC2

DOS

IR

Vibrations