Geometry & MOs

Info

ID:	441881
PubChem CID:	135246345
Reduced:	BrF2N2O2H11C13 (1)
Stoich.:	AB2C2D2E11F13 (1)
Weight, g/mol:	364.178693
ΔH_f, kcal/mol:	-102.55
Dipole, Da:	5.93
IP(EA), eV:	-9.77(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-3-[2-[4-(1-methoxy-2-methylpropan-2-yl)phenoxy]pyridin-3-yl]pyridine

Drug info:

PubChemData

Smile

COCC(C1=NC=C(C=C1)OC2=C(C=CC=N2)Br)(F)F

DOS

IR

Vibrations