Geometry & MOs

Info

ID:	396681
PubChem CID:	135029027
Reduced:	NSO2C23H31 (1)
Stoich.:	ABC2D23E31 (1)
Weight, g/mol:	484.059229
ΔH_f, kcal/mol:	-22.8
Dipole, Da:	4.16
IP(EA), eV:	-8.37(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7,15-dihydroxytetraphenylen-2-yl) trifluoromethanesulfonate

Drug info:

PubChemData

Smile

CC1(CCCC(N1OC(CS(=O)C2=CC=CC=C2)C3=CC=CC=C3)(C)C)C

DOS

IR

Vibrations