Geometry & MOs

Info

ID:	265300
PubChem CID:	103516819
Reduced:	FN2C5H9 (2)
Stoich.:	AB2C5D9 (2)
Weight, g/mol:	204.118653
ΔH_f, kcal/mol:	-78.19
Dipole, Da:	6.56
IP(EA), eV:	-9.32(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-difluoro-3-(2-propyl-1,2,4-triazol-3-yl)propan-2-amine

Drug info:

PubChemData

Smile

CCCN1C(=NC=N1)CC(C(F)F)NCC

DOS

IR

Vibrations