Geometry & MOs

Info

ID:	401404
PubChem CID:	135051181
Reduced:	ClNO3H12C14 (1)
Stoich.:	ABC3D12E14 (1)
Weight, g/mol:	355.1815
ΔH_f, kcal/mol:	15.64
Dipole, Da:	2.62
IP(EA), eV:	-10.06(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-methoxycarbonyloxy-4-(2-trimethylsilylethynyl)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C/C(=C\C(=C(/C=C)\Cl)\[N+](=O)[O-])/C(=O)C1=CC=CC=C1

DOS

IR

Vibrations