Geometry & MOs

Info

ID:	144794
PubChem CID:	53414709
Reduced:	IOF3H4C8 (1)
Stoich.:	ABC3D4E8 (1)
Weight, g/mol:	216.111007
ΔH_f, kcal/mol:	-147.16
Dipole, Da:	3.89
IP(EA), eV:	-10.1(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1=C(C=C(C=C1C(F)(F)F)I)C=O

DOS

IR

Vibrations