Geometry & MOs

Info

ID:	132231
PubChem CID:	51326398
Reduced:	NO2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	329.173942
ΔH_f, kcal/mol:	-126.57
Dipole, Da:	3.11
IP(EA), eV:	-8.34(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-hydroxyphenyl)piperidin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Drug info:

PubChemData

Smile

C1COC2=C(C=C(C=C2)NC(=O)CN3CCC(CC3)C4=CC=C(C=C4)O)OC1

DOS

IR

Vibrations