Geometry & MOs

Info

ID:	289596
PubChem CID:	104359910
Reduced:	BrNO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	396.94999
ΔH_f, kcal/mol:	-64.95
Dipole, Da:	4.52
IP(EA), eV:	-8.74(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromo-2,3-dihydro-1-benzofuran-7-yl)methyl]-1-(4-bromophenyl)methanamine

Drug info:

PubChemData

Smile

C1CC(OC1)CNCC2=CC(=CC3=C2OCC3)Br

DOS

IR

Vibrations