Geometry & MOs

Info

ID:	264818
PubChem CID:	103493230
Reduced:	ClINO4C11H11 (1)
Stoich.:	ABCD4E11F11 (1)
Weight, g/mol:	311.00184
ΔH_f, kcal/mol:	-147.33
Dipole, Da:	5.5
IP(EA), eV:	-9.58(-2.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(cyclobutanecarbonylamino)-2-iodopropanoate

Drug info:

PubChemData

Smile

COC(=O)C(CNC(=O)C1=C(C=C(C=C1)Cl)O)I

DOS

IR

Vibrations