Geometry & MOs

Info

ID:	309294
PubChem CID:	126542779
Reduced:	FNH10C13 (1)
Stoich.:	ABC10D13 (1)
Weight, g/mol:	415.157229
ΔH_f, kcal/mol:	-2.01
Dipole, Da:	3.52
IP(EA), eV:	-9.03(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenyl-10-azahexacyclo[16.3.3.01,18.02,11.04,9.012,17]tetracosa-2,4,6,8,10,12,14,16-octaene-20,23-dione

Drug info:

PubChemData

Smile

C1CC2=C(C=CC(=C2)F)C3=C1C=CC=N3

DOS

IR

Vibrations