Geometry & MOs

Info

ID:	390119
PubChem CID:	134997165
Reduced:	OSH12C14 (1)
Stoich.:	ABC12D14 (1)
Weight, g/mol:	374.256943
ΔH_f, kcal/mol:	40.92
Dipole, Da:	2.2
IP(EA), eV:	-8.72(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4R,11S)-10-tert-butyl-1,1-diethyl-7,7-dimethyl-11-phenyl-2,5,9-trioxa-8,10-diazadispiro[2.0.44.33]undecane

Drug info:

PubChemData

Smile

C1C(O1)C2=CC=CC=C2SC3=CC=CC=C3

DOS

IR

Vibrations