Geometry & MOs

Info

ID:	277666
PubChem CID:	103830266
Reduced:	BrO3C10H11 (1)
Stoich.:	AB3C10D11 (1)
Weight, g/mol:	369.97869
ΔH_f, kcal/mol:	-112.43
Dipole, Da:	2.08
IP(EA), eV:	-9.51(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-bromo-3-fluorophenyl)sulfonyl-7,8-dihydro-5H-1,6-naphthyridine

Drug info:

PubChemData

Smile

CCCOC(=O)C1=CC(=C(C=C1)Br)O

DOS

IR

Vibrations