Geometry & MOs

Info

ID:	275241
PubChem CID:	103814763
Reduced:	OSN3C10H17 (1)
Stoich.:	ABC3D10E17 (1)
Weight, g/mol:	275.109233
ΔH_f, kcal/mol:	-36.65
Dipole, Da:	3.54
IP(EA), eV:	-9.41(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-3-phenylpropanamide

Drug info:

PubChemData

Smile

CC1=CN=C(S1)CNC(=O)C(C(C)C)N

DOS

IR

Vibrations