Geometry & MOs

Info

ID:	287858
PubChem CID:	104296561
Reduced:	BrNOC16H18 (1)
Stoich.:	ABCD16E18 (1)
Weight, g/mol:	398.96564
ΔH_f, kcal/mol:	-6.18
Dipole, Da:	1.87
IP(EA), eV:	-8.7(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromo-2-ethoxyphenyl)-(4-bromo-3-methylphenyl)methanamine

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C(C2=CC(=C(C=C2)Br)C)N

DOS

IR

Vibrations