Geometry & MOs

Info

ID:	154423
PubChem CID:	56313858
Reduced:	FO2N6H17C22 (1)
Stoich.:	AB2C6D17E22 (1)
Weight, g/mol:	484.085067
ΔH_f, kcal/mol:	49.13
Dipole, Da:	4.73
IP(EA), eV:	-9.35(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-methylphenyl)sulfamoyl]-N-[2-[[3-(trifluoromethyl)pyridin-2-yl]amino]ethyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)OC2=C(C=C(C=C2)/C=C/C(=O)NCC3=C(N=CC=C3)N4C=NC=N4)F

DOS

IR

Vibrations