Geometry & MOs

Info

ID:	258369
PubChem CID:	103153260
Reduced:	NO5C13H19 (1)
Stoich.:	AB5C13D19 (1)
Weight, g/mol:	301.073242
ΔH_f, kcal/mol:	-220.46
Dipole, Da:	3.19
IP(EA), eV:	-9.07(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(OC(=C1C(=O)NCC(CC(=O)O)OC)C)C

DOS

IR

Vibrations