Geometry & MOs

Info

ID:	263421
PubChem CID:	103366350
Reduced:	N2F3C11H21 (1)
Stoich.:	A2B3C11D21 (1)
Weight, g/mol:	317.107514
ΔH_f, kcal/mol:	-185.11
Dipole, Da:	4.02
IP(EA), eV:	-9.14(1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-2-[[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

CN(CC1CCCC1)CC(CN)C(F)(F)F

DOS

IR

Vibrations