Geometry & MOs

Info

ID:	248932
PubChem CID:	103085615
Reduced:	ClFN5C12H15 (1)
Stoich.:	ABC5D12E15 (1)
Weight, g/mol:	313.110566
ΔH_f, kcal/mol:	30.12
Dipole, Da:	5.1
IP(EA), eV:	-9.88(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[(3-chloro-4-fluorophenyl)methyl]tetrazol-5-yl]-N-(2-methoxyethyl)ethanamine

Drug info:

PubChemData

Smile

CCNC(C)C1=NN=NN1CC2=CC(=C(C=C2)F)Cl

DOS

IR

Vibrations