Geometry & MOs

Info

ID:	401512
PubChem CID:	135051499
Reduced:	S5H10C12 (1)
Stoich.:	A5B10C12 (1)
Weight, g/mol:	445.0595
ΔH_f, kcal/mol:	73.61
Dipole, Da:	6.63
IP(EA), eV:	-8.13(-2.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl-phenyl-(5-phenylbenzo[b]phosphindol-5-ylidene)azanium;bromide

Drug info:

PubChemData

Smile

C1C/C(=C/2\C=CSS2)/C3=C(C1)/C(=C/C=S)/SS3

DOS

IR

Vibrations