Geometry & MOs

Info

ID:	78272
PubChem CID:	49684244
Reduced:	SN3O4C22H31 (1)
Stoich.:	AB3C4D22E31 (1)
Weight, g/mol:	434.223929
ΔH_f, kcal/mol:	-151.97
Dipole, Da:	6.47
IP(EA), eV:	-8.56(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[(2,5-dimethylfuran-3-yl)methyl]piperidin-4-yl]methyl]-4-(2-methylpropoxy)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(O1)C)CN2CCC(CC2)CNS(=O)(=O)C3=C(C=C(C=C3)NC(=O)C)C

DOS

IR

Vibrations