Geometry & MOs

Info

ID:	3139
PubChem CID:	9212
Reduced:	NH11C14 (1)
Stoich.:	AB11C14 (1)
Weight, g/mol:	193.089149
ΔH_f, kcal/mol:	66.96
Dipole, Da:	0.91
IP(EA), eV:	-8.14(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11H-benzo[b][1]benzazepine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=CC=CC=C3N2

DOS

IR

Vibrations