Geometry & MOs

Info

ID:	275243
PubChem CID:	103814779
Reduced:	OSN3C12H19 (1)
Stoich.:	ABC3D12E19 (1)
Weight, g/mol:	227.109233
ΔH_f, kcal/mol:	-38.86
Dipole, Da:	4.05
IP(EA), eV:	-9.32(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CN=C(S1)CNC(=O)C2CCC(CC2)N

DOS

IR

Vibrations