Geometry & MOs

Info

ID:	248392
PubChem CID:	103081302
Reduced:	BrOF2N2C9H11 (1)
Stoich.:	ABC2D2E9F11 (1)
Weight, g/mol:	331.01318
ΔH_f, kcal/mol:	-111.51
Dipole, Da:	4.03
IP(EA), eV:	-8.91(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-bromo-N-[2-(2,2-difluoroethoxy)ethyl]-1,5-naphthyridin-4-amine

Drug info:

PubChemData

Smile

C1=CC(=NC=C1Br)NCCOCC(F)F

DOS

IR

Vibrations