Geometry & MOs

Info

ID:	230234
PubChem CID:	87570483
Reduced:	PO6C35H71 (1)
Stoich.:	AB6C35D71 (1)
Weight, g/mol:	524.177953
ΔH_f, kcal/mol:	-461.59
Dipole, Da:	3.9
IP(EA), eV:	-10.1(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dichloro-4-methyl-N-[(3R)-3-[4-[(3-methyl-2-oxo-1-thiophen-3-ylbutyl)amino]piperidin-1-yl]butyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCO[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(O)O

DOS

IR

Vibrations