Geometry & MOs

Info

ID:	199410
PubChem CID:	79242475
Reduced:	ClN2O3C13H13 (1)
Stoich.:	AB2C3D13E13 (1)
Weight, g/mol:	253.179027
ΔH_f, kcal/mol:	-69.09
Dipole, Da:	5.39
IP(EA), eV:	-8.82(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethylamino]-N-(2-methylpropyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CNC2=C(C=C(C=C2)Cl)C(=O)O

DOS

IR

Vibrations