Geometry & MOs

Info

ID:	143684
PubChem CID:	53247180
Reduced:	ON2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	372.208279
ΔH_f, kcal/mol:	6.32
Dipole, Da:	4.91
IP(EA), eV:	-7.97(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(2,6-dimethylphenyl)-2-[ethyl(propyl)amino]butanamide;methanesulfonic acid

Drug info:

PubChemData

Smile

C1C2CC(C1NC3=CC4=C(C=C3)NN=C4)N(C2)CC5=CC(=CC=C5)OCCO

DOS

IR

Vibrations