Geometry & MOs

Info

ID:	248899
PubChem CID:	103085361
Reduced:	F3C5N5H8 (1)
Stoich.:	A3B5C5D8 (1)
Weight, g/mol:	237.12013
ΔH_f, kcal/mol:	-89.05
Dipole, Da:	4.18
IP(EA), eV:	-10.36(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C1=NN=NN1CC(F)(F)F)N

DOS

IR

Vibrations