Geometry & MOs

Info

ID:	56118
PubChem CID:	17415722
Reduced:	ClSN2O2C17H19 (1)
Stoich.:	ABC2D2E17F19 (1)
Weight, g/mol:	314.174276
ΔH_f, kcal/mol:	-38.68
Dipole, Da:	2.7
IP(EA), eV:	-8.99(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(3-methylphenyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CN(CC1=CC=C(S1)Cl)CC(=O)NC2CCOC3=CC=CC=C23

DOS

IR

Vibrations