Geometry & MOs

Info

ID:	392565
PubChem CID:	135017180
Reduced:	OSiC20H42 (1)
Stoich.:	ABC20D42 (1)
Weight, g/mol:	415.124215
ΔH_f, kcal/mol:	-160.29
Dipole, Da:	1.31
IP(EA), eV:	-8.72(1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylphenyl)sulfonyl-5-naphthalen-2-yloxy-1,3-dihydroisoindole

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCCCCCCCCCCCCC=C

DOS

IR

Vibrations