Geometry & MOs

Info

ID:	285606
PubChem CID:	104115206
Reduced:	N2O3C9H14 (1)
Stoich.:	A2B3C9D14 (1)
Weight, g/mol:	225.147727
ΔH_f, kcal/mol:	-107.29
Dipole, Da:	2.72
IP(EA), eV:	-9.1(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-propylpiperazin-1-yl)-1,3-oxazol-4-yl]methanol

Drug info:

PubChemData

Smile

C1CN(CCC1O)C2=NC(=CO2)CO

DOS

IR

Vibrations