Geometry & MOs

Info

ID:	204082
PubChem CID:	79908778
Reduced:	ON2C7H12 (2)
Stoich.:	AB2C7D12 (2)
Weight, g/mol:	254.120132
ΔH_f, kcal/mol:	-34.07
Dipole, Da:	4.58
IP(EA), eV:	-9.11(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)triazol-4-amine

Drug info:

PubChemData

Smile

COCCNCC1=CN(N=N1)C2CCOC3(C2)CCC3

DOS

IR

Vibrations