Geometry & MOs

Info

ID:	407384
PubChem CID:	135079967
Reduced:	O2C7H10 (2)
Stoich.:	A2B7C10 (2)
Weight, g/mol:	778.462866
ΔH_f, kcal/mol:	-144.91
Dipole, Da:	0.46
IP(EA), eV:	-9.07(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (E,2R,3S)-3-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-[(2S,3R)-2,3-dimethyl-4-phenylmethoxybutyl]-2-[4-[(4-methoxyphenyl)methoxy]butyl]hex-4-enoate

Drug info:

PubChemData

Smile

C/C=C/C=C/CC(CC=C)(C(=O)OC)C(=O)OC

DOS

IR

Vibrations