Geometry & MOs

Info

ID:	256646
PubChem CID:	103140431
Reduced:	OSN5C11H21 (1)
Stoich.:	ABC5D11E21 (1)
Weight, g/mol:	299.177982
ΔH_f, kcal/mol:	12.88
Dipole, Da:	6.03
IP(EA), eV:	-9.3(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[2-[5-[(5-methyloxolan-2-yl)methylsulfanyl]tetrazol-1-yl]ethyl]propan-2-amine

Drug info:

PubChemData

Smile

CCNCCN1C(=NN=N1)SCC2CCC(O2)C

DOS

IR

Vibrations