Geometry & MOs

Info

ID:	213412
PubChem CID:	81063625
Reduced:	N2O3C12H18 (1)
Stoich.:	A2B3C12D18 (1)
Weight, g/mol:	285.078327
ΔH_f, kcal/mol:	-128.2
Dipole, Da:	4.06
IP(EA), eV:	-9.13(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-acetamido-1,3-thiazole-4-carbonyl)amino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CCN1C=CC=C1C(=O)NCC(C)CC(=O)O

DOS

IR

Vibrations