Geometry & MOs

Info

ID:	287808
PubChem CID:	104295049
Reduced:	NOF2C13H13 (1)
Stoich.:	ABC2D13E13 (1)
Weight, g/mol:	227.032875
ΔH_f, kcal/mol:	-98.39
Dipole, Da:	1.43
IP(EA), eV:	-10.1(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,4-difluoro-5-methylphenyl)-1,3,4-thiadiazol-2-amine

Drug info:

PubChemData

Smile

CCCC(C#N)C(=O)C1=C(C=C(C(=C1)C)F)F

DOS

IR

Vibrations