Geometry & MOs

Info

ID:	183886
PubChem CID:	77086167
Reduced:	ON3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	336.158626
ΔH_f, kcal/mol:	-8.62
Dipole, Da:	2.34
IP(EA), eV:	-9.12(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenyl-5-[(4-pyrimidin-2-yloxypiperidin-1-yl)methyl]-1,2-oxazole

Drug info:

PubChemData

Smile

CC(=O)NC1CCCN(C1)CC2=C3C=CC=NC3=CC=C2

DOS

IR

Vibrations