Geometry & MOs

Info

ID:	149811
PubChem CID:	53789488
Reduced:	ClSiN2O2C21H33 (1)
Stoich.:	ABC2D2E21F33 (1)
Weight, g/mol:	468.302831
ΔH_f, kcal/mol:	-132.42
Dipole, Da:	4.03
IP(EA), eV:	-8.55(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3S)-3-[2-(8-cyclohexyloctyl)phenyl]oxiran-2-yl]-naphthalen-2-ylmethanone

Drug info:

PubChemData

Smile

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)O)Cl)CO[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations