Geometry & MOs

Info

ID:	195603
PubChem CID:	78708472
Reduced:	OF2N2H20C22 (1)
Stoich.:	AB2C2D20E22 (1)
Weight, g/mol:	408.124557
ΔH_f, kcal/mol:	-66.86
Dipole, Da:	3.26
IP(EA), eV:	-8.93(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[1-(2,4-dichloroanilino)-1-oxopropan-2-yl]-[2-(2,5-dimethylanilino)-2-oxoethyl]-methylazanium

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)F)NCCC3=CC=C(C=C3)F

DOS

IR

Vibrations