Geometry & MOs

Info

ID:	157464
PubChem CID:	56430319
Reduced:	FN2O4C22H23 (1)
Stoich.:	AB2C4D22E23 (1)
Weight, g/mol:	447.161663
ΔH_f, kcal/mol:	-140.51
Dipole, Da:	4.03
IP(EA), eV:	-8.96(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-methylphenyl)propanoylamino]ethyl 2-(6-phenylimidazo[2,1-b][1,3]thiazol-3-yl)acetate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CCC(=O)NCCOC(=O)C2CC(=NO2)C3=CC(=CC=C3)F

DOS

IR

Vibrations