Geometry & MOs

Info

ID:	252334
PubChem CID:	103110640
Reduced:	ON3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	309.166411
ΔH_f, kcal/mol:	-48.3
Dipole, Da:	3.54
IP(EA), eV:	-8.52(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-5-(trifluoromethyl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1N)CNC(=O)NC(C)C

DOS

IR

Vibrations