Geometry & MOs

Info

ID:	164396
PubChem CID:	74393670
Reduced:	ClON2C11H14 (2)
Stoich.:	ABC2D11E14 (2)
Weight, g/mol:	360.269586
ΔH_f, kcal/mol:	-62.98
Dipole, Da:	18.53
IP(EA), eV:	-7.66(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[tert-butyl(dimethyl)silyl]oxy-2-methyl-4-(2,2,5-trimethyl-1,3-dioxan-4-yl)pentan-1-ol

Drug info:

PubChemData

Smile

CC(C)NC(=C1C=CC2=CC(=C3C=CC(=CC3=O)C(=NC(C)C)N)OC2=C1)N.Cl.Cl

DOS

IR

Vibrations