Geometry & MOs

Info

ID:	344989
PubChem CID:	127268749
Reduced:	FNS2O5C15H20 (1)
Stoich.:	ABC2D5E15F20 (1)
Weight, g/mol:	379.088972
ΔH_f, kcal/mol:	-243.31
Dipole, Da:	6.54
IP(EA), eV:	-9.65(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(7-fluoro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-2,3-dihydro-1,4-benzodioxine-5-sulfonamide

Drug info:

PubChemData

Smile

C1CC(C2=C(C=CC(=C2)F)OC1)NS(=O)(=O)C3CCS(=O)(=O)CC3

DOS

IR

Vibrations