Geometry & MOs

Info

ID:	447323
PubChem CID:	135282019
Reduced:	BrF2N2O3C14H19 (1)
Stoich.:	AB2C2D3E14F19 (1)
Weight, g/mol:	329.210327
ΔH_f, kcal/mol:	-231.82
Dipole, Da:	3.8
IP(EA), eV:	-9.48(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-methoxy-5-(2-methylpyridin-4-yl)pyridin-2-yl]oxy-2,4-dimethylpentan-2-amine

Drug info:

PubChemData

Smile

CC(C)CC(C)(COC1=C(N=C(C=C1)Br)C(F)F)NC(=O)O

DOS

IR

Vibrations