Geometry & MOs

Info

ID:	383229
PubChem CID:	134974844
Reduced:	ClNS2O3C16H22 (1)
Stoich.:	ABC2D3E16F22 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	-120.9
Dipole, Da:	5.01
IP(EA), eV:	-9.17(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4'R)-3'-(4-azidobutyl)spiro[1,3-dioxolane-2,5'-bicyclo[2.2.1]heptane]-2'-one

Drug info:

PubChemData

Smile

CCOC(=S)SC(CCC1=CN=C(C=C1)Cl)OC(=O)C(C)(C)C

DOS

IR

Vibrations