Geometry & MOs

Info

ID:	257950
PubChem CID:	103149318
Reduced:	NOSF2C11H17 (1)
Stoich.:	ABCD2E11F17 (1)
Weight, g/mol:	276.176168
ΔH_f, kcal/mol:	-135.49
Dipole, Da:	4.1
IP(EA), eV:	-9.03(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,2-difluoroethoxy)-N-methyl-1-(2-propyl-1,2,4-triazol-3-yl)butan-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=CS1)C(CCOCC(F)F)NC

DOS

IR

Vibrations