Geometry & MOs

Info

ID:	125037
PubChem CID:	50907803
Reduced:	SeO2N5H15C19 (1)
Stoich.:	AB2C5D15E19 (1)
Weight, g/mol:	339.00232
ΔH_f, kcal/mol:	36.64
Dipole, Da:	4.76
IP(EA), eV:	-8.65(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

20-methyl-11-selena-3,5,6,8,13-pentazapentacyclo[10.8.0.02,10.05,9.014,19]icosa-1(20),2(10),3,6,8,12,14,16,18-nonaene

Drug info:

PubChemData

Smile

CCOC(=O)CC1=NN2C=NC3=C(C2=N1)[Se]C4=NC5=CC=CC=C5C(=C34)C

DOS

IR

Vibrations