Geometry & MOs

Info

ID:	257960
PubChem CID:	103149340
Reduced:	NOF2C13H19 (1)
Stoich.:	ABC2D13E19 (1)
Weight, g/mol:	322.04923
ΔH_f, kcal/mol:	-138.38
Dipole, Da:	4.21
IP(EA), eV:	-9.18(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromopyridin-3-yl)-4-(2,2-difluoroethoxy)-N-methylbutan-2-amine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(CCOCC(F)F)NC

DOS

IR

Vibrations