Geometry & MOs

Info

ID:	390797
PubChem CID:	135000988
Reduced:	NSeBr2O2H19C23 (1)
Stoich.:	ABC2D2E19F23 (1)
Weight, g/mol:	271.97001
ΔH_f, kcal/mol:	20.13
Dipole, Da:	1.53
IP(EA), eV:	-8.76(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-2-methyl-4-nitro-1,3-benzoselenazole

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2=NC(=C[Se]2(Br)Br)C3=CC=C(C=C3)C4=CC=CC=C4)OC

DOS

IR

Vibrations