Geometry & MOs

Info

ID:	243718
PubChem CID:	99234271
Reduced:	OSN2C21H34 (1)
Stoich.:	ABC2D21E34 (1)
Weight, g/mol:	427.230491
ΔH_f, kcal/mol:	-66.65
Dipole, Da:	2.33
IP(EA), eV:	-8.57(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]butyl]-2-fluoro-5-(propan-2-ylsulfamoyl)benzamide

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@H](CN(C1)CCCCNC(=O)C2=CC=CC=C2SC(C)C)C

DOS

IR

Vibrations