Geometry & MOs

Info

ID:	32549
PubChem CID:	7843069
Reduced:	O2H10C11 (2)
Stoich.:	A2B10C11 (2)
Weight, g/mol:	409.163771
ΔH_f, kcal/mol:	-99.25
Dipole, Da:	2.17
IP(EA), eV:	-8.78(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl] 2-(4-cyanophenoxy)acetate

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(=O)COC(=O)COC2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations