Geometry & MOs

Info

ID:	46170
PubChem CID:	10522770
Reduced:	N2O2F6H10C15 (1)
Stoich.:	A2B2C6D10E15 (1)
Weight, g/mol:	364.073559
ΔH_f, kcal/mol:	-262.46
Dipole, Da:	4.2
IP(EA), eV:	-9.37(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

heptacyclo[8.6.4.42,9.01,10.02,9.03,8.011,16]tetracosa-3,5,7,11,13,15,18,22-octaene-17,20,21,24-tetrone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(C2=CC=C(C=C2)[N+](=O)[O-])(C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations