Geometry & MOs

Info

ID:	248985
PubChem CID:	103086042
Reduced:	Br2N5C10H11 (1)
Stoich.:	A2B5C10D11 (1)
Weight, g/mol:	325.05382
ΔH_f, kcal/mol:	91.76
Dipole, Da:	6.55
IP(EA), eV:	-9.32(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(5-bromo-2-methoxyphenyl)tetrazol-5-yl]-N-ethylethanamine

Drug info:

PubChemData

Smile

CC(C1=NN=NN1C2=C(C=C(C=C2)Br)Br)NC

DOS

IR

Vibrations