Geometry & MOs

Info

ID:	55555
PubChem CID:	17395536
Reduced:	ON3C22H27 (1)
Stoich.:	AB3C22D27 (1)
Weight, g/mol:	302.106671
ΔH_f, kcal/mol:	-4.15
Dipole, Da:	2.67
IP(EA), eV:	-8.24(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-yl)-2-(3-fluoro-4-methylanilino)acetamide

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C2C1)NC(=O)CN3CCN(CC3)C4=CC=CC=C4

DOS

IR

Vibrations