Geometry & MOs

Info

ID:	217797
PubChem CID:	85088407
Reduced:	NOC13H14 (2)
Stoich.:	ABC13D14 (2)
Weight, g/mol:	400.170601
ΔH_f, kcal/mol:	-49.88
Dipole, Da:	2.22
IP(EA), eV:	-8.53(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,3-dioxolan-2-yl] acetate

Drug info:

PubChemData

Smile

CCCCCC1C(C2=C(C3C1C(=O)N(C3=O)C4=CC=CC=C4)NC5=CC=CC=C52)C

DOS

IR

Vibrations