Geometry & MOs

Info

ID:	231716
PubChem CID:	87574506
Reduced:	AsO3C8H9 (1)
Stoich.:	AB3C8D9 (1)
Weight, g/mol:	457.05004
ΔH_f, kcal/mol:	-38.93
Dipole, Da:	5.72
IP(EA), eV:	-7.36(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-bromo-1'-[4-(difluoromethoxy)-3-fluorophenyl]spiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol

Drug info:

PubChemData

Smile

CC(C(C1=CC=CO1)C(=O)O)[As]

DOS

IR

Vibrations