Geometry & MOs

Info

ID:	60158
PubChem CID:	26675802
Reduced:	INSO4H14C15 (1)
Stoich.:	ABCD4E14F15 (1)
Weight, g/mol:	488.064522
ΔH_f, kcal/mol:	-103.61
Dipole, Da:	4.25
IP(EA), eV:	-9.32(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[4-[(4,6-diamino-1,3,5-triazin-2-yl)methoxy]phenyl]-N-methyl-3-(trifluoromethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=CC=C1NC(=O)COC2=CC(=CC=C2)I

DOS

IR

Vibrations