Geometry & MOs

Info

ID:	244485
PubChem CID:	99355721
Reduced:	SO3N4C16H24 (1)
Stoich.:	AB3C4D16E24 (1)
Weight, g/mol:	386.077279
ΔH_f, kcal/mol:	-104.53
Dipole, Da:	11.15
IP(EA), eV:	-8.98(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dimethyl-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]imidazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)NNC(=O)C23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations