Geometry & MOs

Info

ID:	285585
PubChem CID:	104115029
Reduced:	N3O4C13H21 (1)
Stoich.:	A3B4C13D21 (1)
Weight, g/mol:	297.168856
ΔH_f, kcal/mol:	-137.53
Dipole, Da:	2.86
IP(EA), eV:	-9.06(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[4-(3-aminopropoxy)piperidin-1-yl]-1,3-oxazole-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=COC(=N1)NCCOC2CCNCC2

DOS

IR

Vibrations