Geometry & MOs

Info

ID:	360047
PubChem CID:	127300315
Reduced:	O2N5C20H33 (1)
Stoich.:	A2B5C20D33 (1)
Weight, g/mol:	394.201634
ΔH_f, kcal/mol:	-118.33
Dipole, Da:	4.09
IP(EA), eV:	-8.8(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylcarbamoylamino]piperidin-1-yl]-N,N-dimethylacetamide

Drug info:

PubChemData

Smile

CC(=O)NC1CCC(CC1)NC(=O)NC2CCC3=NC(=CN3C2)C(C)(C)C

DOS

IR

Vibrations