Geometry & MOs

Info

ID:	44399
PubChem CID:	10503373
Reduced:	N2O3C27H42 (1)
Stoich.:	A2B3C27D42 (1)
Weight, g/mol:	442.253936
ΔH_f, kcal/mol:	-157.89
Dipole, Da:	3.18
IP(EA), eV:	-9.2(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-1-naphthalen-1-ylethyl] (3R)-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxy-3-methylhex-5-enoate

Drug info:

PubChemData

Smile

CC(C)(C)[C@H]1N=C([C@@](N1C(=O)OC(C)(C)C)(CC2CCCCC2)CC3=CC=CC=C3)OC

DOS

IR

Vibrations