Geometry & MOs

Info

ID:	449950
PubChem CID:	135302773
Reduced:	OC7H15 (2)
Stoich.:	AB7C15 (2)
Weight, g/mol:	420.146741
ΔH_f, kcal/mol:	-145.5
Dipole, Da:	2.3
IP(EA), eV:	-9.53(2.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(hydroxymethyl)-1,1-dioxothietan-3-yl]methyl (8R)-5-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-5-azaspiro[2.5]octane-8-carboxylate

Drug info:

PubChemData

Smile

CC(C)C(C)(C)CCOC(C)(C)CCOC

DOS

IR

Vibrations