Geometry & MOs

Info

ID:	35744
PubChem CID:	7980274
Reduced:	NO2C8H10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	365.071093
ΔH_f, kcal/mol:	-122.61
Dipole, Da:	6.36
IP(EA), eV:	-9.39(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] 2-phenoxyacetate

Drug info:

PubChemData

Smile

CC(C)[C@](C)(C#N)NC(=O)COC(=O)COC1=CC=CC=C1

DOS

IR

Vibrations