Geometry & MOs

Info

ID:	161373
PubChem CID:	57391486
Reduced:	SO2F3N5H12C16 (1)
Stoich.:	AB2C3D5E12F16 (1)
Weight, g/mol:	634.187556
ΔH_f, kcal/mol:	-135.2
Dipole, Da:	3.73
IP(EA), eV:	-9.14(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3-methyl-4-propoxy-2-[3-(trifluoromethoxy)phenyl]imino-6-(trifluoromethyl)benzimidazol-1-yl]methyl]-N-(2H-tetrazol-5-yl)benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)S(=O)(=O)NC2=CN=CC(=C2)C3=CN=C(N=C3)N)C(F)(F)F

DOS

IR

Vibrations