Geometry & MOs

Info

ID:	12180
PubChem CID:	131894
Reduced:	N2O3C16H20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	288.147393
ΔH_f, kcal/mol:	-73.79
Dipole, Da:	4.64
IP(EA), eV:	-9.29(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-[2-(methylamino)-3-(2-methylpropyl)phenyl]-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C2=CC=CC(=C2NC)CC(C)C)C(=O)O

DOS

IR

Vibrations