Geometry & MOs

Info

ID:	249061
PubChem CID:	103086554
Reduced:	BrClN5C9H9 (1)
Stoich.:	ABC5D9E9 (1)
Weight, g/mol:	225.15896
ΔH_f, kcal/mol:	97.3
Dipole, Da:	4.48
IP(EA), eV:	-10.1(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[1-[(2-methyloxolan-2-yl)methyl]tetrazol-5-yl]ethanamine

Drug info:

PubChemData

Smile

CC(C1=NN=NN1C2=CC(=C(C=C2)Cl)Br)N

DOS

IR

Vibrations