Geometry & MOs

Info

ID:	379532
PubChem CID:	134440814
Reduced:	N4C11H11 (2)
Stoich.:	A4B11C11 (2)
Weight, g/mol:	366.111061
ΔH_f, kcal/mol:	160.95
Dipole, Da:	1.31
IP(EA), eV:	-8.61(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-[1-(2-chloro-5-methylphenyl)ethenyl]-2,4-difluoro-3-N-(3-fluorobut-1-en-2-yl)benzene-1,3-diamine

Drug info:

PubChemData

Smile

CCC1=C(N(N=C1NC2=CC(=NC=N2)N3C(=CC(=N3)C)C)C)C4=CC=C(C=C4)C#N

DOS

IR

Vibrations