Geometry & MOs

Info

ID:	25960
PubChem CID:	634968
Reduced:	SiO2C30H38 (1)
Stoich.:	AB2C30D38 (1)
Weight, g/mol:	444.171893
ΔH_f, kcal/mol:	-123.54
Dipole, Da:	1.82
IP(EA), eV:	-8.38(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[4-(4-morpholin-4-ylphenyl)sulfonylphenyl]piperidin-4-yl] acetate

Drug info:

PubChemData

Smile

CCCCCC1=CC2=C(C(=C1)O[Si](C)(C)CC3=CC=CC=C3)C4=C(C=CC(=C4)C)C(O2)(C)C

DOS

IR

Vibrations