Geometry & MOs

Info

ID:	25145
PubChem CID:	619513
Reduced:	NO2C6H7 (2)
Stoich.:	AB2C6D7 (2)
Weight, g/mol:	250.121846
ΔH_f, kcal/mol:	-137.71
Dipole, Da:	9.38
IP(EA), eV:	-8.72(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-6,7,8,9-tetrahydroimidazo[1,2-b][1,2,4]benzotriazine

Drug info:

PubChemData

Smile

CCOC1=C2C(=C(C=C1)OCC)NC(=O)C(=O)N2

DOS

IR

Vibrations