Geometry & MOs

Info

ID:	245664
PubChem CID:	99494361
Reduced:	SN2F3O3H17C20 (1)
Stoich.:	AB2C3D3E17F20 (1)
Weight, g/mol:	391.139287
ΔH_f, kcal/mol:	-212.56
Dipole, Da:	4.41
IP(EA), eV:	-8.81(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2,5-dioxoimidazolidin-1-yl)methyl]-N-[2-methyl-5-(tetrazol-1-yl)phenyl]benzamide

Drug info:

PubChemData

Smile

C1=CSC(=C1)CCCC(=O)NC2=C(C=C(C=C2)NC(=O)C3=COC=C3)C(F)(F)F

DOS

IR

Vibrations