Geometry & MOs

Info

ID:	392047
PubChem CID:	135012232
Reduced:	SiO4C20H28 (1)
Stoich.:	AB4C20D28 (1)
Weight, g/mol:	504.244434
ΔH_f, kcal/mol:	-134.17
Dipole, Da:	2.96
IP(EA), eV:	-8.94(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[5-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]ethynyl]-2-(2-trimethylsilylethynyl)phenyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC/C=C\CC1(C=CC(=O)C=C1)C#CC(=O)OC

DOS

IR

Vibrations