Geometry & MOs

Info

ID:	225361
PubChem CID:	85756513
Reduced:	N2O3C17H20 (1)
Stoich.:	A2B3C17D20 (1)
Weight, g/mol:	230.116761
ΔH_f, kcal/mol:	-82.13
Dipole, Da:	2.86
IP(EA), eV:	-8.09(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-piperidin-1-yl-4aH-1,2,3-benzotriazin-4-one

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)NC(=O)NC2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations