Geometry & MOs

Info

ID:	291800
PubChem CID:	113556415
Reduced:	ON3C14H25 (1)
Stoich.:	AB3C14D25 (1)
Weight, g/mol:	268.124549
ΔH_f, kcal/mol:	-44.16
Dipole, Da:	5.0
IP(EA), eV:	-8.47(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-(4-methoxy-2-methylphenyl)-4-methylsulfanylbutanamide

Drug info:

PubChemData

Smile

CCCC(C(C1=C(C=CN=C1N)C)NCC)OC

DOS

IR

Vibrations