Geometry & MOs

Info

ID:	421365
PubChem CID:	135115871
Reduced:	N2O5C25H34 (1)
Stoich.:	A2B5C25D34 (1)
Weight, g/mol:	329.171497
ΔH_f, kcal/mol:	-204.44
Dipole, Da:	8.53
IP(EA), eV:	-8.52(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-4-[[methyl-[3-(trifluoromethyl)pyridin-2-yl]amino]methyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)CCOC23CCN(CC3)C(=O)C4CC(=O)N(C4)C5CCCC5)OC

DOS

IR

Vibrations