Geometry & MOs

Info

ID:	378101
PubChem CID:	134224172
Reduced:	ON2H14C15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	423.162314
ΔH_f, kcal/mol:	30.7
Dipole, Da:	4.16
IP(EA), eV:	-8.43(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,10-diphenyl-1-azapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2(7),3,5,8(20),9,11,13,15-octaen-19-one

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)C(=N)C2=CC=CC=C2N

DOS

IR

Vibrations