Geometry & MOs

Info

ID:	329506
PubChem CID:	126737674
Reduced:	FSN2O2C8H17 (1)
Stoich.:	ABC2D2E8F17 (1)
Weight, g/mol:	659.224915
ΔH_f, kcal/mol:	-146.0
Dipole, Da:	3.66
IP(EA), eV:	-8.87(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

19-(3-triphenylen-2-ylphenyl)-9-oxa-19-azaheptacyclo[15.11.0.02,10.03,8.011,16.018,26.020,25]octacosa-1(17),2(10),3,5,7,11,13,15,18(26),20,22,24,27-tridecaene

Drug info:

PubChemData

Smile

CC(C)N1CCC(CC1)(F)S(=O)(=O)N

DOS

IR

Vibrations