Geometry & MOs

Info

ID:	357708
PubChem CID:	127294382
Reduced:	FSN2O2C14H19 (1)
Stoich.:	ABC2D2E14F19 (1)
Weight, g/mol:	387.161663
ΔH_f, kcal/mol:	-109.11
Dipole, Da:	2.62
IP(EA), eV:	-9.57(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(azepan-1-yl)pyridin-4-yl]methyl]-1,3-dihydro-2-benzofuran-5-sulfonamide

Drug info:

PubChemData

Smile

C1CCN(C1)S(=O)(=O)N2CCC(C2)C3=CC=CC=C3F

DOS

IR

Vibrations