Geometry & MOs

Info

ID:	148849
PubChem CID:	53788518
Reduced:	OS2N3C15H33 (1)
Stoich.:	AB2C3D15E33 (1)
Weight, g/mol:	543.06725
ΔH_f, kcal/mol:	-97.6
Dipole, Da:	2.72
IP(EA), eV:	-8.91(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-trimethylsilylethyl 2-(2-bromoethoxy)-6-(4,6-dimethoxypyrimidin-2-yl)oxy-3-nitrobenzoate

Drug info:

PubChemData

Smile

CC(C)(CNCCNCCCCC(=O)NCC(C)(C)S)S

DOS

IR

Vibrations