Geometry & MOs

Info

ID:	328556
PubChem CID:	126724520
Reduced:	ON3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	315.192232
ΔH_f, kcal/mol:	-31.26
Dipole, Da:	1.49
IP(EA), eV:	-9.27(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-5-methyl-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]pyridin-2-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=NC=N1)N[C@@H]2CCOC2

DOS

IR

Vibrations