Geometry & MOs

Info

ID:	226671
PubChem CID:	87551007
Reduced:	ClN2O4C17H21 (1)
Stoich.:	AB2C4D17E21 (1)
Weight, g/mol:	231.0707
ΔH_f, kcal/mol:	-163.45
Dipole, Da:	3.35
IP(EA), eV:	-8.69(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

fluoro N-fluoro-N-(2-methoxy-2-phenylethyl)carbamate

Drug info:

PubChemData

Smile

CCCCOC(=O)OC(=O)[C@](C)(CC1=CNC2=C1C=CC(=C2)Cl)N

DOS

IR

Vibrations