Geometry & MOs

Info

ID:	355773
PubChem CID:	127290625
Reduced:	NSO2C9H13 (2)
Stoich.:	ABC2D9E13 (2)
Weight, g/mol:	378.107185
ΔH_f, kcal/mol:	-140.25
Dipole, Da:	7.4
IP(EA), eV:	-8.57(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-2-methyl-2,3-dihydro-1-benzofuran-5-sulfonamide

Drug info:

PubChemData

Smile

CC1CC2=C(O1)C=CC(=C2)S(=O)(=O)NCC3(CCSC3)N4CCOCC4

DOS

IR

Vibrations