Geometry & MOs

Info

ID:	249047
PubChem CID:	103086496
Reduced:	FN5C14H20 (1)
Stoich.:	AB5C14D20 (1)
Weight, g/mol:	249.138974
ΔH_f, kcal/mol:	23.92
Dipole, Da:	6.36
IP(EA), eV:	-9.56(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-[1-(3-fluoro-5-methylphenyl)tetrazol-5-yl]ethanamine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)F)N2C(=NN=N2)C(C)NCC(C)C

DOS

IR

Vibrations