Geometry & MOs

Info

ID:	85770
PubChem CID:	49878994
Reduced:	FO2N6H17C19 (1)
Stoich.:	AB2C6D17E19 (1)
Weight, g/mol:	445.10316
ΔH_f, kcal/mol:	3.36
Dipole, Da:	2.64
IP(EA), eV:	-8.96(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(dimethylsulfamoyl)-2-(trifluoromethyl)benzimidazol-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Drug info:

PubChemData

Smile

C1CN(CCN1C2=NN(C(=O)C=C2)C3=CC=C(C=C3)F)C(=O)C4=NC=CN=C4

DOS

IR

Vibrations