Geometry & MOs

Info

ID:	289831
PubChem CID:	104377148
Reduced:	SBr2N2C8H12 (1)
Stoich.:	AB2C2D8E12 (1)
Weight, g/mol:	290.01854
ΔH_f, kcal/mol:	40.07
Dipole, Da:	3.33
IP(EA), eV:	-9.16(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(3-bromo-2-chlorophenyl)methyl]-N-ethylethane-1,2-diamine

Drug info:

PubChemData

Smile

CNCCNCC1=CC(=C(S1)Br)Br

DOS

IR

Vibrations