Geometry & MOs

Info

ID:	402582
PubChem CID:	135056474
Reduced:	NOC11H13 (1)
Stoich.:	ABC11D13 (1)
Weight, g/mol:	351.0599
ΔH_f, kcal/mol:	-8.34
Dipole, Da:	1.9
IP(EA), eV:	-9.2(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E,1R)-1-(4-methoxyphenyl)-5-oxopent-3-enyl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

C[C@@H]1C=CO[C@H]1C2=C(N=CC=C2)C

DOS

IR

Vibrations