Geometry & MOs

Info

ID:	63160
PubChem CID:	26746560
Reduced:	N2O7C22H22 (1)
Stoich.:	A2B7C22D22 (1)
Weight, g/mol:	265.131408
ΔH_f, kcal/mol:	-164.0
Dipole, Da:	6.14
IP(EA), eV:	-8.66(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(4-ethoxyanilino)-1-oxopropan-2-yl] propanoate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1C(=O)NNC(=O)C2=CC=C(O2)COC3=CC=CC=C3)OC)OC

DOS

IR

Vibrations