Geometry & MOs

Info

ID:	257918
PubChem CID:	103149178
Reduced:	OSF2N2C14H18 (1)
Stoich.:	ABC2D2E14F18 (1)
Weight, g/mol:	262.160518
ΔH_f, kcal/mol:	-110.76
Dipole, Da:	2.02
IP(EA), eV:	-9.03(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CNC(CCOCC(F)F)CC1=NC2=CC=CC=C2S1

DOS

IR

Vibrations