Geometry & MOs

Info

ID:	408801
PubChem CID:	135081569
Reduced:	NOH7C11 (1)
Stoich.:	ABC7D11 (1)
Weight, g/mol:	299.99142
ΔH_f, kcal/mol:	36.43
Dipole, Da:	7.39
IP(EA), eV:	-8.7(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC2=CC(=O)C=C3N2C(=C1)C=C3

DOS

IR

Vibrations