Geometry & MOs

Info

ID:	130249
PubChem CID:	51075378
Reduced:	SN3O3C12H23 (1)
Stoich.:	AB3C3D12E23 (1)
Weight, g/mol:	341.177313
ΔH_f, kcal/mol:	-95.69
Dipole, Da:	4.24
IP(EA), eV:	-9.07(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]azepane-1-sulfonamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)NCC(C1=CC=CO1)N(C)C

DOS

IR

Vibrations