Geometry & MOs

Info

ID:	186460
PubChem CID:	77436876
Reduced:	N3O3C9H11 (1)
Stoich.:	A3B3C9D11 (1)
Weight, g/mol:	565.315595
ΔH_f, kcal/mol:	-51.87
Dipole, Da:	5.79
IP(EA), eV:	-9.83(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-[4-[[tert-butyl(diphenyl)silyl]oxymethyl]-6-[hydroxy(dimethyl)silyl]-6-methylhept-1-ynyl]-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

C1=NC(=NC(=O)C1C#CCC(CO)O)N

DOS

IR

Vibrations