Geometry & MOs

Info

ID:	390646
PubChem CID:	135000138
Reduced:	NOSnC31H51 (1)
Stoich.:	ABCD31E51 (1)
Weight, g/mol:	992.0558
ΔH_f, kcal/mol:	-78.78
Dipole, Da:	4.6
IP(EA), eV:	-8.62(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis[[4-(4-bromophenyl)-2,6-diphenylpyrimidin-5-yl]-dimethyl-lambda4-sulfanyl] sulfate

Drug info:

PubChemData

Smile

CCCC[Sn](CCCC)(CCCC)[C@H](C)C1=C(C2=CC=CC=C2C=C1)C(=O)N(C(C)C)C(C)C

DOS

IR

Vibrations