Geometry & MOs

Info

ID:	259209
PubChem CID:	103159498
Reduced:	ClO3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	273.121237
ΔH_f, kcal/mol:	-155.33
Dipole, Da:	4.17
IP(EA), eV:	-9.6(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(3-ethoxycyclobutyl)acetyl]amino]butanedioic acid

Drug info:

PubChemData

Smile

C1CCC(C1)CC(CC(CC2=CC=C(C=C2)Cl)C(=O)O)O

DOS

IR

Vibrations