Geometry & MOs

Info

ID:	248861
PubChem CID:	103085053
Reduced:	N5C15H23 (1)
Stoich.:	A5B15C23 (1)
Weight, g/mol:	287.210996
ΔH_f, kcal/mol:	82.03
Dipole, Da:	5.66
IP(EA), eV:	-9.33(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-(2,6-diethylphenyl)tetrazol-5-yl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCC1=C(C(=CC=C1)CC)N2C(=NN=N2)C(C)NCC

DOS

IR

Vibrations