Geometry & MOs

Info

ID:	244777
PubChem CID:	99381452
Reduced:	SN3O3C18H25 (1)
Stoich.:	AB3C3D18E25 (1)
Weight, g/mol:	361.236542
ΔH_f, kcal/mol:	-131.61
Dipole, Da:	3.09
IP(EA), eV:	-9.2(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2R)-1-[4-[2-(diethylamino)ethoxy]benzoyl]piperidin-2-yl]acetamide

Drug info:

PubChemData

Smile

C1CCN([C@@H](C1)CC(=O)N)C(=O)CCC(=O)N2CCC3=C(C2)C=CS3

DOS

IR

Vibrations