Geometry & MOs

Info

ID:	401797
PubChem CID:	135052642
Reduced:	NSTeO3C16H17 (1)
Stoich.:	ABCD3E16F17 (1)
Weight, g/mol:	505.088598
ΔH_f, kcal/mol:	102.16
Dipole, Da:	3.85
IP(EA), eV:	-7.91(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,4S)-5-chloro-4,6-diphenyl-1-piperidin-1-yl-6-trimethylsilyl-2,7-dithia-5-phosphabicyclo[2.2.1]heptan-3-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=[N+](C2=CC=CC=C2[Te]1)C

DOS

IR

Vibrations