Geometry & MOs

Info

ID:	229125
PubChem CID:	87567012
Reduced:	ClN2O6C34H53 (1)
Stoich.:	AB2C6D34E53 (1)
Weight, g/mol:	262.092912
ΔH_f, kcal/mol:	-249.26
Dipole, Da:	2.47
IP(EA), eV:	-8.34(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methoxy-N-methyl-3-[6-(trifluoromethyl)pyridin-3-yl]propanamide

Drug info:

PubChemData

Smile

CC1(CC(CC(N1C)(C)C)OC(=O)C(=CC2=CC=C(C=C2)OC)C(=O)OC3CC(N(C(C3)(C)C)C)(C)C)C.C1C(O1)CCl

DOS

IR

Vibrations