Geometry & MOs

Info

ID:	204084
PubChem CID:	79908780
Reduced:	ON2C6H10 (2)
Stoich.:	AB2C6D10 (2)
Weight, g/mol:	296.167083
ΔH_f, kcal/mol:	-50.69
Dipole, Da:	5.64
IP(EA), eV:	-9.0(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)-5-propan-2-yltriazol-4-amine

Drug info:

PubChemData

Smile

CC1=C(N=NN1C2CCOC3(C2)CCOCC3)N

DOS

IR

Vibrations