Geometry & MOs

Info

ID:	219541
PubChem CID:	85149157
Reduced:	NO4H31C38 (1)
Stoich.:	AB4C31D38 (1)
Weight, g/mol:	566.13493
ΔH_f, kcal/mol:	-27.13
Dipole, Da:	7.56
IP(EA), eV:	-8.78(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[8-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-iodooxocan-2-yl]methyl formate

Drug info:

PubChemData

Smile

C1C2=CC=CC=C2C3=CC=CC(=C31)C=CCOC4=CC=C(C=C4)CC(C(=O)O)NC5=CC=CC=C5C(=O)C6=CC=CC=C6

DOS

IR

Vibrations