Geometry & MOs

Info

ID:	248869
PubChem CID:	103085104
Reduced:	F2N5C13H17 (1)
Stoich.:	A2B5C13D17 (1)
Weight, g/mol:	267.129552
ΔH_f, kcal/mol:	-6.65
Dipole, Da:	4.42
IP(EA), eV:	-9.57(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-(3,4-difluorophenyl)tetrazol-5-yl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CC(C)CNC(C)C1=NN=NN1C2=CC(=C(C=C2)F)F

DOS

IR

Vibrations