Geometry & MOs

Info

ID:	382201
PubChem CID:	134973192
Reduced:	SSiO2C6H16 (1)
Stoich.:	ABC2D6E16 (1)
Weight, g/mol:	444.09094
ΔH_f, kcal/mol:	-119.08
Dipole, Da:	3.57
IP(EA), eV:	-8.39(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[1-benzyl-8-bromo-6-oxo-9-(oxolan-2-yl)purin-2-yl]-N,N-dimethylmethanimidamide

Drug info:

PubChemData

Smile

COS(=O)CC[Si](C)(C)C

DOS

IR

Vibrations