Geometry & MOs

Info

ID:	178836
PubChem CID:	76387738
Reduced:	ClSiN5O5C30H40 (1)
Stoich.:	ABC5D5E30F40 (1)
Weight, g/mol:	366.161329
ΔH_f, kcal/mol:	-206.33
Dipole, Da:	4.52
IP(EA), eV:	-8.7(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-N-(3-hydroxycyclohexyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1=NC2=C(C(=N1)Cl)N=CN2C3CC(C(C3=C)CO[Si](C)(C)C(C)(C)C)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations