Geometry & MOs

Info

ID:	264006
PubChem CID:	103415420
Reduced:	Br2O2C15H22 (1)
Stoich.:	A2B2C15D22 (1)
Weight, g/mol:	256.189926
ΔH_f, kcal/mol:	-84.18
Dipole, Da:	1.33
IP(EA), eV:	-9.53(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[3-(2-methoxyethoxy)propyl]triazol-4-yl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

COCCOCCCC(CC1=CC(=CC=C1)Br)CBr

DOS

IR

Vibrations