Geometry & MOs

Info

ID:	32798
PubChem CID:	7848515
Reduced:	FSN2O4C21H21 (1)
Stoich.:	ABC2D4E21F21 (1)
Weight, g/mol:	367.037813
ΔH_f, kcal/mol:	-168.93
Dipole, Da:	5.47
IP(EA), eV:	-9.49(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(3,5-dichlorophenoxy)acetamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NCCC1=CC=C(C=C1)F)OC(=O)C2=CC3=C(C=C2)SCCC(=O)N3

DOS

IR

Vibrations