Geometry & MOs

Info

ID:	55332
PubChem CID:	17390061
Reduced:	O2N3C11H13 (1)
Stoich.:	A2B3C11D13 (1)
Weight, g/mol:	184.121178
ΔH_f, kcal/mol:	-3.1
Dipole, Da:	2.84
IP(EA), eV:	-9.55(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-aminoethyl)-3-tert-butyl-2H-1,2-oxazol-5-one

Drug info:

PubChemData

Smile

C1=CN=CC=C1C2=C(C(=O)ON2)CCCN

DOS

IR

Vibrations