Geometry & MOs

Info

ID:	258669
PubChem CID:	103156174
Reduced:	SO4C13H18 (1)
Stoich.:	AB4C13D18 (1)
Weight, g/mol:	255.158292
ΔH_f, kcal/mol:	-161.08
Dipole, Da:	5.87
IP(EA), eV:	-9.25(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-methoxybutanamide

Drug info:

PubChemData

Smile

C1CCC(C1)CC(COC2=CSC(=C2)C(=O)O)O

DOS

IR

Vibrations