Geometry & MOs

Info

ID:	396270
PubChem CID:	135027895
Reduced:	NOF3H14C17 (1)
Stoich.:	ABC3D14E17 (1)
Weight, g/mol:	383.163377
ΔH_f, kcal/mol:	-102.08
Dipole, Da:	2.54
IP(EA), eV:	-8.89(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(dimethylamino)ethyl]-6-phenyl-1,3-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16),10,12,14-hexaene-2,4-dione

Drug info:

PubChemData

Smile

CN(C)CC1=C(OC2=C1C(=C(C=C2F)F)F)C3=CC=CC=C3

DOS

IR

Vibrations