Geometry & MOs

Info

ID:	139876
PubChem CID:	52610684
Reduced:	ON2F3C17H23 (1)
Stoich.:	AB2C3D17E23 (1)
Weight, g/mol:	437.271213
ΔH_f, kcal/mol:	-199.89
Dipole, Da:	5.35
IP(EA), eV:	-8.78(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[4-[(2S)-2-methylpiperidin-1-yl]butyl]pentanamide

Drug info:

PubChemData

Smile

C[C@H]1CCCN(C1)CCCNC(=O)C2=CC=C(C=C2)C(F)(F)F

DOS

IR

Vibrations