Geometry & MOs

Info

ID:	185253
PubChem CID:	77276278
Reduced:	BrFO2N3H17C21 (1)
Stoich.:	ABC2D3E17F21 (1)
Weight, g/mol:	384.148535
ΔH_f, kcal/mol:	-35.11
Dipole, Da:	4.07
IP(EA), eV:	-9.21(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-7'-(3,6-dihydro-2H-pyran-4-yl)-5'-fluorospiro[morpholine-2,9'-xanthene]-2'-ol

Drug info:

PubChemData

Smile

C1C(OC2(CN1)C3=C(C=CC(=C3)C4=CC(=NC=C4)F)OC5=C2C=C(C=C5)Br)N

DOS

IR

Vibrations