Geometry & MOs

Info

ID:	76833
PubChem CID:	48425447
Reduced:	F2N2O3C15H20 (1)
Stoich.:	A2B2C3D15E20 (1)
Weight, g/mol:	335.166748
ΔH_f, kcal/mol:	-211.89
Dipole, Da:	3.62
IP(EA), eV:	-9.31(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentylsulfanyl-N-[2-(diethylamino)-2-oxoethyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CCOC1=C(C=C(C=C1)F)F

DOS

IR

Vibrations