Geometry & MOs

Info

ID:	257920
PubChem CID:	103149183
Reduced:	NF2O2C10H21 (1)
Stoich.:	AB2C2D10E21 (1)
Weight, g/mol:	296.144868
ΔH_f, kcal/mol:	-204.28
Dipole, Da:	3.76
IP(EA), eV:	-9.06(1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,2-difluoroethoxy)-N-methyl-1-(3-phenyltriazol-4-yl)propan-1-amine

Drug info:

PubChemData

Smile

CNC(CCCOC)CCOCC(F)F

DOS

IR

Vibrations