Geometry & MOs

Info

ID:	327841
PubChem CID:	126691144
Reduced:	N2O2C25H32 (1)
Stoich.:	A2B2C25D32 (1)
Weight, g/mol:	221.084064
ΔH_f, kcal/mol:	-73.36
Dipole, Da:	2.88
IP(EA), eV:	-8.76(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methylidene-5H-benzo[c][1]benzazepin-11-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@@H]1CCCN(C1)C2C3=CC=CC=C3CCC4=CC=CC=C24

DOS

IR

Vibrations