Geometry & MOs

Info

ID:	285339
PubChem CID:	104100118
Reduced:	N2F3O3C12H13 (1)
Stoich.:	A2B3C3D12E13 (1)
Weight, g/mol:	284.09277
ΔH_f, kcal/mol:	-257.91
Dipole, Da:	4.51
IP(EA), eV:	-10.16(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[2-[1-hydroxypropan-2-yl(methyl)amino]-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)C(=O)NCC(=O)NCC(C(F)F)O

DOS

IR

Vibrations