Geometry & MOs

Info

ID:	289610
PubChem CID:	104360232
Reduced:	ClON2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	270.03678
ΔH_f, kcal/mol:	-25.42
Dipole, Da:	2.51
IP(EA), eV:	-8.76(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(5-bromo-2,3-dihydro-1-benzofuran-7-yl)methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

C1COC2=C1C=C(C=C2CNCCN)Cl

DOS

IR

Vibrations