Geometry & MOs

Info

ID:	157512
PubChem CID:	56435343
Reduced:	O2S2F3N3C17H20 (1)
Stoich.:	A2B2C3D3E17F20 (1)
Weight, g/mol:	404.140593
ΔH_f, kcal/mol:	-178.3
Dipole, Da:	5.96
IP(EA), eV:	-9.01(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-methylbenzamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCCOCC(F)(F)F)C(=O)C2=CN=C(S2)C3=CC=CS3

DOS

IR

Vibrations