Geometry & MOs

Info

ID:	299057
PubChem CID:	117670396
Reduced:	OSF3N4H23C24 (1)
Stoich.:	ABC3D4E23F24 (1)
Weight, g/mol:	476.07495
ΔH_f, kcal/mol:	-109.69
Dipole, Da:	11.28
IP(EA), eV:	-8.87(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(4-iodophenyl)-1-N-methyl-4-N,4-N-diphenylbenzene-1,4-diamine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=S)N(C(C23CCC3)N(C)C(=O)C)C4=CC(=C(C=C4)C#N)C(F)(F)F

DOS

IR

Vibrations