Geometry & MOs

Info

ID:	265296
PubChem CID:	103516780
Reduced:	F2N3C14H19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	218.134303
ΔH_f, kcal/mol:	-61.88
Dipole, Da:	2.78
IP(EA), eV:	-8.48(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC(CC1=NN(C2=CC=CC=C21)CC)C(F)F

DOS

IR

Vibrations