Geometry & MOs

Info

ID:	47180
PubChem CID:	10530335
Reduced:	NSO7C28H39 (1)
Stoich.:	ABC7D28E39 (1)
Weight, g/mol:	533.335662
ΔH_f, kcal/mol:	-321.78
Dipole, Da:	7.84
IP(EA), eV:	-9.35(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S,3S)-2,3-bis[[tert-butyl(dimethyl)silyl]oxymethyl]-1-[3-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]cyclobutan-1-ol

Drug info:

PubChemData

Smile

CCCCCN(CCOC(=O)C(C)(C)C)C(=O)C(CCC(=O)O)CS(=O)(=O)C1=CC2=CC=CC=C2C=C1

DOS

IR

Vibrations