Geometry & MOs

Info

ID:	69059
PubChem CID:	46516901
Reduced:	NO5C20H21 (1)
Stoich.:	AB5C20D21 (1)
Weight, g/mol:	424.138284
ΔH_f, kcal/mol:	-173.45
Dipole, Da:	2.69
IP(EA), eV:	-8.8(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-oxo-1-(phenylcarbamoylamino)propan-2-yl] 3-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCCOC(=O)COC2=CC3=C(C=C2)NC(=O)CC3

DOS

IR

Vibrations