Geometry & MOs

Info

ID:	262746
PubChem CID:	103313732
Reduced:	NO3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	285.184112
ΔH_f, kcal/mol:	-78.2
Dipole, Da:	3.1
IP(EA), eV:	-8.93(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,4,5-tetrahydro-1-benzazepin-2-one

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2NC(=O)C1OC3=CC=CC(=C3)O

DOS

IR

Vibrations