Geometry & MOs

Info

ID:	263982
PubChem CID:	103412253
Reduced:	ClO2N3C11H20 (1)
Stoich.:	AB2C3D11E20 (1)
Weight, g/mol:	392.9762
ΔH_f, kcal/mol:	-56.96
Dipole, Da:	3.11
IP(EA), eV:	-9.77(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dibromo-5-methoxyphenyl)-2,6-dimethyloxan-4-amine

Drug info:

PubChemData

Smile

COCCOCCCN1C=C(N=N1)CCCCl

DOS

IR

Vibrations