Geometry & MOs

Info

ID:	280027
PubChem CID:	103846450
Reduced:	BrON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	338.09938
ΔH_f, kcal/mol:	-37.64
Dipole, Da:	3.63
IP(EA), eV:	-9.38(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-2,3-dihydro-1H-inden-1-amine

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC1CCC2=C1C=CC=C2Br

DOS

IR

Vibrations