Geometry & MOs

Info

ID:	295440
PubChem CID:	117528827
Reduced:	BrON2H13C15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	246.009913
ΔH_f, kcal/mol:	38.63
Dipole, Da:	4.12
IP(EA), eV:	-9.15(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-pyridin-4-yl-7H-pyrano[3,4-d][1,3]thiazole-4,6-dione

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=C2)Br)N=C1COC3=CC=CC=C3

DOS

IR

Vibrations