Geometry & MOs

Info

ID:	408953
PubChem CID:	135081725
Reduced:	NOH9C15 (1)
Stoich.:	ABC9D15 (1)
Weight, g/mol:	299.99142
ΔH_f, kcal/mol:	40.62
Dipole, Da:	2.33
IP(EA), eV:	-8.42(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenyl-2-selena-5,7,11,12-tetrazatricyclo[6.3.1.04,12]dodeca-1(11),3,5,7,9-pentaene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=CC=C4N3C(=CC=C4)C2=O

DOS

IR

Vibrations