Geometry & MOs

Info

ID:	269045
PubChem CID:	103608237
Reduced:	N3O3C13H27 (1)
Stoich.:	A3B3C13D27 (1)
Weight, g/mol:	301.022974
ΔH_f, kcal/mol:	-128.28
Dipole, Da:	2.29
IP(EA), eV:	-8.72(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloropyridin-3-yl)-5-(trifluoromethyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)CCN1CCN(CC1)C(=O)COCCOC

DOS

IR

Vibrations