Geometry & MOs

Info

ID:	46381
PubChem CID:	10524153
Reduced:	NSO3C22H27 (1)
Stoich.:	ABC3D22E27 (1)
Weight, g/mol:	385.170935
ΔH_f, kcal/mol:	-111.8
Dipole, Da:	1.5
IP(EA), eV:	-9.45(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[tert-butyl(dimethyl)silyl]oxy-4-methoxyphenyl]-3-pyridin-3-ylpropane-1,3-dione

Drug info:

PubChemData

Smile

CCCSC(=O)C1=C(C(=C(N=C1CC)C2=CC=CC=C2)C(=O)OCC)CC

DOS

IR

Vibrations