Geometry & MOs

Info

ID:	289900
PubChem CID:	104385132
Reduced:	BrN2F3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	228.220164
ΔH_f, kcal/mol:	-149.05
Dipole, Da:	7.51
IP(EA), eV:	-8.93(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-N-(2-piperidin-1-ylethyl)pentan-1-amine

Drug info:

PubChemData

Smile

C1CCN(CC1)CCNCC2=CC(=C(C=C2)Br)C(F)(F)F

DOS

IR

Vibrations