Geometry & MOs

Info

ID:	17713
PubChem CID:	514105
Reduced:	NO3H9C10 (1)
Stoich.:	AB3C9D10 (1)
Weight, g/mol:	191.058243
ΔH_f, kcal/mol:	-63.1
Dipole, Da:	6.03
IP(EA), eV:	-9.81(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-4,5-dihydro-2-benzazepine-1,3-dione

Drug info:

PubChemData

Smile

C1CC(=O)N(C(=O)C2=CC=CC=C21)O

DOS

IR

Vibrations