Geometry & MOs

Info

ID:	218341
PubChem CID:	85089204
Reduced:	SSiO4C24H38 (1)
Stoich.:	ABC4D24E38 (1)
Weight, g/mol:	450.14924
ΔH_f, kcal/mol:	-252.52
Dipole, Da:	3.99
IP(EA), eV:	-8.82(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-oxo-1-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]pentan-2-yl] N-(5-chlorothiophen-2-yl)carbamate

Drug info:

PubChemData

Smile

CCCS(=O)(=O)OC1=CC2=C(C=C1)C3CCC4(C(C3CC2)CCC4O[Si](C)(C)C)C

DOS

IR

Vibrations