Geometry & MOs

Info

ID:	153979
PubChem CID:	56313337
Reduced:	NF3O3C23H26 (1)
Stoich.:	AB3C3D23E26 (1)
Weight, g/mol:	416.097683
ΔH_f, kcal/mol:	-242.27
Dipole, Da:	4.07
IP(EA), eV:	-8.74(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-(dimethylamino)pyridin-3-yl]-3-[(4-methylphenyl)sulfamoyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)CCC(=O)NCC2(CCC2)C3=CC=CC=C3)OCC(F)(F)F

DOS

IR

Vibrations