Geometry & MOs

Info

ID:	392829
PubChem CID:	135018133
Reduced:	NSSiO3C11H20 (2)
Stoich.:	ABCD3E11F20 (2)
Weight, g/mol:	379.178358
ΔH_f, kcal/mol:	-323.75
Dipole, Da:	4.05
IP(EA), eV:	-8.93(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S)-2-[[(2E,4E)-5-(4-methoxyphenyl)penta-2,4-dienoyl]amino]-3-phenylpropanoate

Drug info:

PubChemData

Smile

COC(=O)[C@@H](NC(=O)/C=C/C[Si](C)(C)C)CSSC[C@H](NC(=O)/C=C/C[Si](C)(C)C)C(=O)OC

DOS

IR

Vibrations