Geometry & MOs

Info

ID:	275250
PubChem CID:	103814831
Reduced:	OSN3C12H19 (1)
Stoich.:	ABC3D12E19 (1)
Weight, g/mol:	255.140533
ΔH_f, kcal/mol:	-35.48
Dipole, Da:	4.6
IP(EA), eV:	-8.91(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-4-methylpentanamide

Drug info:

PubChemData

Smile

CCC1=CN=C(S1)CNC(=O)C2CCCNC2

DOS

IR

Vibrations