Geometry & MOs

Info

ID:	382265
PubChem CID:	134973319
Reduced:	SN2O9C22H22 (1)
Stoich.:	AB2C9D22E22 (1)
Weight, g/mol:	305.159976
ΔH_f, kcal/mol:	-313.25
Dipole, Da:	6.48
IP(EA), eV:	-9.42(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-phenylethyl)-1-[2-(2-trimethylsilylethynyl)phenyl]methanimine

Drug info:

PubChemData

Smile

CC(=O)OCC1[C@@H](C(C([C@@H](O1)SC2=CC(=C(C=C2)C#N)C#N)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations