Geometry & MOs

Info

ID:	68278
PubChem CID:	46508100
Reduced:	ClSN2O6C23H23 (1)
Stoich.:	ABC2D6E23F23 (1)
Weight, g/mol:	364.182064
ΔH_f, kcal/mol:	-153.81
Dipole, Da:	6.52
IP(EA), eV:	-9.42(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2-oxoazepan-1-yl)propyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)OCC3=CC(=NO3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations