Geometry & MOs

Info

ID:	429947
PubChem CID:	135170002
Reduced:	ClISN3H9C16 (1)
Stoich.:	ABCD3E9F16 (1)
Weight, g/mol:	320.150033
ΔH_f, kcal/mol:	112.81
Dipole, Da:	2.92
IP(EA), eV:	-9.15(-2.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1Z)-2-[N-[2-[(1Z)-buta-1,3-dienyl]-3-methylphenyl]-C-(trifluoromethyl)carbonimidoyl]-3-methylbuta-1,3-dien-1-amine

Drug info:

PubChemData

Smile

C1=CC2=C(N=C1)N(C=C2C3=CC4=C(C=CN=C4C=C3)Cl)SI

DOS

IR

Vibrations