Geometry & MOs

Info

ID:	285507
PubChem CID:	104109942
Reduced:	ClNOC15H22 (1)
Stoich.:	ABCD15E22 (1)
Weight, g/mol:	253.123342
ΔH_f, kcal/mol:	-57.94
Dipole, Da:	3.0
IP(EA), eV:	-8.51(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)pentan-2-amine

Drug info:

PubChemData

Smile

CC(CC(C)Cl)NCCC1=CC2=C(C=C1)OCC2

DOS

IR

Vibrations