Geometry & MOs

Info

ID:	219932
PubChem CID:	85165059
Reduced:	PO8C33H63 (1)
Stoich.:	AB8C33D63 (1)
Weight, g/mol:	618.312514
ΔH_f, kcal/mol:	-542.64
Dipole, Da:	2.9
IP(EA), eV:	-10.8(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenyl)ethyl 6-benzyl-5-[tert-butyl(dimethyl)silyl]oxy-3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazinane-4-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC(=O)OCC(COP1(=O)OCCO1)OC(=O)CCCCCCCCCCC

DOS

IR

Vibrations