Geometry & MOs

Info

ID:	83747
PubChem CID:	49860907
Reduced:	ClN4C12H14 (2)
Stoich.:	AB4C12D14 (2)
Weight, g/mol:	570.181398
ΔH_f, kcal/mol:	109.42
Dipole, Da:	3.31
IP(EA), eV:	-8.41(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-1-[(E)-[10-[(E)-[(N'-phenylcarbamimidoyl)hydrazinylidene]methyl]anthracen-9-yl]methylideneamino]guanidine;dihydrochloride

Drug info:

PubChemData

Smile

CC1=CC=C(C2=C(C3=CC=CC=C3C(=C12)/C=N/NC4=NCCN4)/C=N/NC5=NCCN5)C.Cl.Cl

DOS

IR

Vibrations