Geometry & MOs

Info

ID:	384294
PubChem CID:	134976701
Reduced:	NSSiO4C23H31 (1)
Stoich.:	ABCD4E23F31 (1)
Weight, g/mol:	516.171893
ΔH_f, kcal/mol:	-162.85
Dipole, Da:	5.12
IP(EA), eV:	-8.83(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S,6S)-6-(4-cyanophenyl)-2-(4-methoxyphenyl)-1-(4-methylphenyl)sulfonyl-3,6-dihydro-2H-pyridine-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C[C@@H](N([C@@H]1C2=CC=CC3=CC=CC=C32)S(=O)(=O)CC[Si](C)(C)C)C

DOS

IR

Vibrations