Geometry & MOs

Info

ID:	37290
PubChem CID:	8019158
Reduced:	NO6C23H25 (1)
Stoich.:	AB6C23D25 (1)
Weight, g/mol:	331.262363
ΔH_f, kcal/mol:	-183.14
Dipole, Da:	5.05
IP(EA), eV:	-8.61(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[methyl-(1-methylpiperidin-4-yl)amino]-N-[(2S)-4-phenylbutan-2-yl]propanamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)C1=CNC2=CC=CC=C21)OC(=O)CCC3=CC(=C(C(=C3)OC)OC)OC

DOS

IR

Vibrations