Geometry & MOs

Info

ID:	200453
PubChem CID:	79390896
Reduced:	SN2O4C12H26 (1)
Stoich.:	AB2C4D12E26 (1)
Weight, g/mol:	223.132077
ΔH_f, kcal/mol:	-200.99
Dipole, Da:	3.96
IP(EA), eV:	-9.09(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-[(2-methylpyrimidin-4-yl)methylamino]butanoic acid

Drug info:

PubChemData

Smile

CCN(CCCNC(C)C(C)C(=O)OC)S(=O)(=O)C

DOS

IR

Vibrations