Geometry & MOs

Info

ID:	159489
PubChem CID:	57288190
Reduced:	O6N8C17H18 (1)
Stoich.:	A6B8C17D18 (1)
Weight, g/mol:	404.243693
ΔH_f, kcal/mol:	-36.57
Dipole, Da:	5.26
IP(EA), eV:	-9.29(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[10-[[2-[amino(dimethylamino)methylidene]hydrazinyl]methylidene]anthracen-9-ylidene]methylamino]-1,1-dimethylguanidine

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN=NC2=NC(=C3C(=N2)N(C=N3)[C@H]4C(C([C@H](O4)CO)O)O)N)[N+](=O)[O-]

DOS

IR

Vibrations