Geometry & MOs

Info

ID:	389644
PubChem CID:	134994238
Reduced:	NC12H23 (1)
Stoich.:	AB12C23 (1)
Weight, g/mol:	461.878063
ΔH_f, kcal/mol:	-20.39
Dipole, Da:	1.9
IP(EA), eV:	-8.94(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4S)-2-chloro-4-(trichloro-lambda4-tellanyl)pentan-3-yl] benzoate

Drug info:

PubChemData

Smile

CC(C)(C=C)[C@@H](C1CCCCC1)N

DOS

IR

Vibrations