Geometry & MOs

Info

ID:	42441
PubChem CID:	8149559
Reduced:	ON2C12H16 (2)
Stoich.:	AB2C12D16 (2)
Weight, g/mol:	408.252526
ΔH_f, kcal/mol:	-50.01
Dipole, Da:	5.2
IP(EA), eV:	-7.87(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(4-morpholin-4-ylphenyl)-2-(4-piperidin-1-ylanilino)propanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=CC=C(C=C1)N2CCOCC2)NC3=CC=C(C=C3)N4CCCCC4

DOS

IR

Vibrations