Geometry & MOs

Info

ID:	221319
PubChem CID:	85267642
Reduced:	SN2O3C21H38 (1)
Stoich.:	AB2C3D21E38 (1)
Weight, g/mol:	398.227721
ΔH_f, kcal/mol:	-200.08
Dipole, Da:	6.45
IP(EA), eV:	-9.21(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[tert-butyl(diphenyl)silyl]oxymethyl]hexanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCOC(=O)CCCCC1C2C(CS1)NC(=O)N2

DOS

IR

Vibrations