Geometry & MOs

Info

ID:	61715
PubChem CID:	26712071
Reduced:	SN2O3C18H28 (1)
Stoich.:	AB2C3D18E28 (1)
Weight, g/mol:	468.153049
ΔH_f, kcal/mol:	-148.03
Dipole, Da:	6.34
IP(EA), eV:	-9.21(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(difluoromethoxy)-N-[4-[(2R,6R)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]-3-methoxybenzamide

Drug info:

PubChemData

Smile

C[C@H]1CCC[C@@H](N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC(C)C)C

DOS

IR

Vibrations