Geometry & MOs

Info

ID:	175544
PubChem CID:	75919556
Reduced:	N2O5C25H30 (1)
Stoich.:	A2B5C25D30 (1)
Weight, g/mol:	440.105134
ΔH_f, kcal/mol:	-168.25
Dipole, Da:	1.64
IP(EA), eV:	-8.24(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxyethyl)-6-methyl-1-[4-(trifluoromethylsulfanyl)phenyl]sulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N(CC3CCCO3)CC4=CC(=CC=C4)OC

DOS

IR

Vibrations