Geometry & MOs

Info

ID:	350106
PubChem CID:	127277184
Reduced:	NSO5C20H21 (1)
Stoich.:	ABC5D20E21 (1)
Weight, g/mol:	361.098394
ΔH_f, kcal/mol:	-143.08
Dipole, Da:	5.53
IP(EA), eV:	-8.85(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-1,3-dihydro-2-benzofuran-5-sulfonamide

Drug info:

PubChemData

Smile

C1CC(N(C1)S(=O)(=O)C2=CC3=C(COC3)C=C2)C4=C5C(=CC=C4)OCCO5

DOS

IR

Vibrations