Geometry & MOs

Info

ID:	245964
PubChem CID:	103031577
Reduced:	BrNO2C16H22 (1)
Stoich.:	ABC2D16E22 (1)
Weight, g/mol:	242.118591
ΔH_f, kcal/mol:	-58.61
Dipole, Da:	1.98
IP(EA), eV:	-9.13(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloropyridin-2-yl)-4-methoxy-4-methylpentan-1-amine

Drug info:

PubChemData

Smile

CC(C)(CCC(C1=CC2=C(O1)C(=CC=C2)Br)NC)OC

DOS

IR

Vibrations