Geometry & MOs

Info

ID:	263651
PubChem CID:	103386587
Reduced:	N3O3H11C12 (1)
Stoich.:	A3B3C11D12 (1)
Weight, g/mol:	256.124549
ΔH_f, kcal/mol:	-62.59
Dipole, Da:	7.15
IP(EA), eV:	-8.41(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2,2-dimethyl-3-[2-(1,3-thiazol-2-yl)propan-2-ylamino]propanoate

Drug info:

PubChemData

Smile

COC1=C(C=CC=N1)NC(=O)C2=CNC=CC2=O

DOS

IR

Vibrations