Geometry & MOs

Info

ID:	248833
PubChem CID:	103084793
Reduced:	ClN5C11H14 (1)
Stoich.:	AB5C11D14 (1)
Weight, g/mol:	325.05382
ΔH_f, kcal/mol:	80.14
Dipole, Da:	7.5
IP(EA), eV:	-9.48(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(4-bromophenyl)tetrazol-5-yl]-N-(2-methoxyethyl)ethanamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N2C(=NN=N2)C(C)NC)Cl

DOS

IR

Vibrations