Geometry & MOs

Info

ID:	168170
PubChem CID:	74932197
Reduced:	N2O2C25H29 (1)
Stoich.:	A2B2C25D29 (1)
Weight, g/mol:	360.119005
ΔH_f, kcal/mol:	3.61
Dipole, Da:	1.47
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.196868
Charge, e:	0

Chem-info

IUPAC name:

dimethyl-[5-(N-methylanilino)penta-2,4-dienylidene]azanium;hexafluorophosphate

Drug info:

PubChemData

Smile

C1COCCN1C(=CC=CC(=[N+]2CCOCC2)C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations