Geometry & MOs

Info

ID:	142985
PubChem CID:	53127416
Reduced:	S2N4O4C19H20 (1)
Stoich.:	A2B4C4D19E20 (1)
Weight, g/mol:	462.103162
ΔH_f, kcal/mol:	-50.75
Dipole, Da:	5.56
IP(EA), eV:	-9.36(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-methoxyphenyl)methyl]-4-[5-(piperidine-1-carbonyl)-1,3,4-oxadiazol-2-yl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNS(=O)(=O)C2=CC(=CS2)C3=NN=C(O3)C(=O)N4CCCC4

DOS

IR

Vibrations