Geometry & MOs

Info

ID:	286156
PubChem CID:	104157362
Reduced:	OF2N2C16H26 (1)
Stoich.:	AB2C2D16E26 (1)
Weight, g/mol:	334.06808
ΔH_f, kcal/mol:	-163.13
Dipole, Da:	4.02
IP(EA), eV:	-9.16(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[(3-bromophenyl)methoxy]-6-ethylpyridin-4-yl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC(=CC(=C1)CNC(C)(C)C)OCC(F)F

DOS

IR

Vibrations