Geometry & MOs

Info

ID:	246778
PubChem CID:	103064868
Reduced:	SN2C15H28 (1)
Stoich.:	AB2C15D28 (1)
Weight, g/mol:	227.120467
ΔH_f, kcal/mol:	-29.24
Dipole, Da:	3.34
IP(EA), eV:	-8.51(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(thiolan-3-yl)tetrazol-5-yl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CCCNC1CC2CCCC(C1)N2C3CCSC3

DOS

IR

Vibrations