Geometry & MOs

Info

ID:	38566
PubChem CID:	8137082
Reduced:	N2O5C21H22 (1)
Stoich.:	A2B5C21D22 (1)
Weight, g/mol:	421.163771
ΔH_f, kcal/mol:	-171.55
Dipole, Da:	9.05
IP(EA), eV:	-8.21(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopropylamino)-2-oxoethyl]-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-ethoxybenzamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CC(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCC3=O

DOS

IR

Vibrations