Geometry & MOs

Info

ID:	264186
PubChem CID:	103439500
Reduced:	BrNO2C11H12 (1)
Stoich.:	ABC2D11E12 (1)
Weight, g/mol:	232.109944
ΔH_f, kcal/mol:	-40.15
Dipole, Da:	2.23
IP(EA), eV:	-8.87(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,5'-oxolane]-2'-one

Drug info:

PubChemData

Smile

COC(=O)C1(CC1)NC2=CC(=CC=C2)Br

DOS

IR

Vibrations