Geometry & MOs

Info

ID:	346721
PubChem CID:	127271225
Reduced:	S2N3O5C14H19 (1)
Stoich.:	A2B3C5D14E19 (1)
Weight, g/mol:	389.129694
ΔH_f, kcal/mol:	-155.08
Dipole, Da:	6.52
IP(EA), eV:	-9.44(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[oxolan-2-yl(phenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Drug info:

PubChemData

Smile

CN1CC(CC1=O)NS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)NC3CC3

DOS

IR

Vibrations