Geometry & MOs

Info

ID:	157697
PubChem CID:	56436620
Reduced:	FSN3O3C18H22 (1)
Stoich.:	ABC3D3E18F22 (1)
Weight, g/mol:	359.257277
ΔH_f, kcal/mol:	-134.77
Dipole, Da:	2.43
IP(EA), eV:	-8.76(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[2-[4-[(2-methylpiperidin-1-yl)methyl]anilino]-2-oxoethyl]pentanamide

Drug info:

PubChemData

Smile

CC(C)CCC(=O)NCC(=O)NC1=NC(=CS1)C2=CC(=C(C=C2)OC)F

DOS

IR

Vibrations