Geometry & MOs

Info

ID:	199948
PubChem CID:	79321988
Reduced:	BrOC17H19 (1)
Stoich.:	ABC17D19 (1)
Weight, g/mol:	362.96564
ΔH_f, kcal/mol:	-6.58
Dipole, Da:	3.57
IP(EA), eV:	-8.4(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,5-dibromo-2-ethoxyphenyl)methylidene]butan-1-amine

Drug info:

PubChemData

Smile

CC(C)C(=CC1=C(C=CC2=CC=CC=C21)OC)CBr

DOS

IR

Vibrations