Geometry & MOs

Info

ID:	275054
PubChem CID:	103813467
Reduced:	OSN3C15H25 (1)
Stoich.:	ABC3D15E25 (1)
Weight, g/mol:	289.124883
ΔH_f, kcal/mol:	-53.9
Dipole, Da:	4.5
IP(EA), eV:	-8.97(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-3-phenylpropanamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CCNC(=O)CC(C)C2CCCNC2

DOS

IR

Vibrations