Geometry & MOs

Info

ID:	261581
PubChem CID:	103241437
Reduced:	O2N3C12H19 (1)
Stoich.:	A2B3C12D19 (1)
Weight, g/mol:	197.080041
ΔH_f, kcal/mol:	-53.29
Dipole, Da:	6.27
IP(EA), eV:	-8.98(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (E)-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]prop-2-enoate

Drug info:

PubChemData

Smile

CN(C)CCCOC1=CC(=O)NC(=N1)C2CC2

DOS

IR

Vibrations