Geometry & MOs

Info

ID:	53544
PubChem CID:	14716571
Reduced:	SeN2O5H18C21 (1)
Stoich.:	AB2C5D18E21 (1)
Weight, g/mol:	472.05374
ΔH_f, kcal/mol:	-50.81
Dipole, Da:	7.16
IP(EA), eV:	-8.63(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dimethyl-6'-nitrospiro[1,3-benzoselenazole-2,2'-chromene]-8'-yl)methyl 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CC(=C)C(=O)OCC1=CC(=CC2=C1OC3(C=C2)N(C4=CC=CC=C4[Se]3)C)[N+](=O)[O-]

DOS

IR

Vibrations