Geometry & MOs

Info

ID:	170441
PubChem CID:	75233346
Reduced:	ON2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	392.274672
ΔH_f, kcal/mol:	-2.38
Dipole, Da:	11.27
IP(EA), eV:	-8.18(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[tert-butyl(dimethyl)silyl]oxy-2,4-dimethyl-1-phenylmethoxyoct-7-en-3-ol

Drug info:

PubChemData

Smile

C1COCCN1C2NC(NC(=C3C=CC(=O)C=C3)N2)CC4=CC=CC=C4

DOS

IR

Vibrations