Geometry & MOs

Info

ID:

397380

PubChem CID:

135030133

Reduced:

OSiC15H22 (1)

Stoich.:

ABC15D22 (1)

Weight, g/mol:

838.474463

ΔHf, kcal/mol:

-38.39

Dipole, Da:

3.85

IP(EA), eV:

-8.8(-0.04)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

benzyl (2S,3S,4R)-3-[(2S)-2-[[2-[(2-diethoxyphosphorylacetyl)-methylamino]acetyl]amino]-2-[(4S)-2,2-dimethyl-5-oxo-1,3-dioxolan-4-yl]acetyl]oxy-2,4,16-trimethylheptadecanoate

Drug info:

PubChemData

Smile

CC1=C(CC(=C(C1)C#C[Si](C)(C)C)C(=O)C)C

DOS

IR

Vibrations