Geometry & MOs

Info

ID:	248967
PubChem CID:	103085908
Reduced:	OSN5C13H21 (1)
Stoich.:	ABC5D13E21 (1)
Weight, g/mol:	279.151767
ΔH_f, kcal/mol:	38.48
Dipole, Da:	6.89
IP(EA), eV:	-9.45(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-[1-(5-methylthiophen-2-yl)ethyl]tetrazol-5-yl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(C)N2C(=NN=N2)C(C)NCCOC

DOS

IR

Vibrations