Geometry & MOs

Info

ID:	373860
PubChem CID:	131320743
Reduced:	ClN2C9H17 (1)
Stoich.:	AB2C9D17 (1)
Weight, g/mol:	178.128155
ΔH_f, kcal/mol:	-10.87
Dipole, Da:	1.64
IP(EA), eV:	-8.84(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4R)-1-(2,2-difluoroethyl)-4-methylpiperidin-3-amine

Drug info:

PubChemData

Smile

C[C@@H]1CCN(C[C@@H]1N)CC(=C)Cl

DOS

IR

Vibrations