Geometry & MOs

Info

ID:	46450
PubChem CID:	10524447
Reduced:	N2H11C13 (2)
Stoich.:	A2B11C13 (2)
Weight, g/mol:	390.226007
ΔH_f, kcal/mol:	124.12
Dipole, Da:	6.09
IP(EA), eV:	-8.63(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-2-prop-2-enylcyclohexyl] methanesulfonate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CC=N2)NCC3=CC(=CC=C3)CNC4=CC=NC5=CC=CC=C54

DOS

IR

Vibrations