Geometry & MOs

Info

ID:	441861
PubChem CID:	135246146
Reduced:	ON5C19H21 (1)
Stoich.:	AB5C19D21 (1)
Weight, g/mol:	375.130695
ΔH_f, kcal/mol:	93.93
Dipole, Da:	1.48
IP(EA), eV:	-8.93(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-(N-amino-2-fluoroanilino)-1-[3-(2,5-difluorophenyl)-1,2,4-oxadiazol-5-yl]but-1-en-1-amine

Drug info:

PubChemData

Smile

C/C(=C(/C1=NC(=NO1)C2=CC=C(C=C2)CN(C)C)\N)/C3=CC=NC=C3

DOS

IR

Vibrations