Geometry & MOs

Info

ID:	249127
PubChem CID:	103087029
Reduced:	SN5C13H27 (1)
Stoich.:	AB5C13D27 (1)
Weight, g/mol:	267.20591
ΔH_f, kcal/mol:	27.88
Dipole, Da:	6.96
IP(EA), eV:	-9.02(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCSCCC(C)N1C(=NN=N1)C(C)NCC(C)C

DOS

IR

Vibrations