Geometry & MOs

Info

ID:	248911
PubChem CID:	103085478
Reduced:	BrN5C11H14 (1)
Stoich.:	AB5C11D14 (1)
Weight, g/mol:	181.132746
ΔH_f, kcal/mol:	96.21
Dipole, Da:	4.6
IP(EA), eV:	-9.59(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(1-cyclopropylethyl)tetrazol-5-yl]ethanamine

Drug info:

PubChemData

Smile

CC(C1=NN=NN1CC2=CC=C(C=C2)Br)NC

DOS

IR

Vibrations