Geometry & MOs

Info

ID:	436855
PubChem CID:	135212309
Reduced:	NO2C10H19 (1)
Stoich.:	AB2C10D19 (1)
Weight, g/mol:	381.04825
ΔH_f, kcal/mol:	-114.42
Dipole, Da:	4.0
IP(EA), eV:	-9.48(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(5R)-2-amino-5-(2,3-difluorophenyl)-4-oxofuran-3-yl] phenylmethanesulfonate

Drug info:

PubChemData

Smile

CCC1COCC(=O)N1C(C)(C)C

DOS

IR

Vibrations