Geometry & MOs

Info

ID:	171490
PubChem CID:	75383990
Reduced:	NCl2O2S2C12H13 (1)
Stoich.:	AB2C2D2E12F13 (1)
Weight, g/mol:	283.135448
ΔH_f, kcal/mol:	-59.91
Dipole, Da:	4.36
IP(EA), eV:	-9.03(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-oxa-2-thiaspiro[4.5]decan-9-yl)-3-propan-2-yl-1,2,4-oxadiazol-5-amine

Drug info:

PubChemData

Smile

C1COCC2C1N(CCS2)C(=O)C3=C(SC(=C3)Cl)Cl

DOS

IR

Vibrations