Geometry & MOs

Info

ID:	126572
PubChem CID:	50968491
Reduced:	F2N2O3C21H22 (1)
Stoich.:	A2B2C3D21E22 (1)
Weight, g/mol:	276.163791
ΔH_f, kcal/mol:	-150.78
Dipole, Da:	6.37
IP(EA), eV:	-8.67(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-N-[2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)ethyl]acetamide

Drug info:

PubChemData

Smile

CCC(CO)(CO)N1C=NC(=C1C2=C(C=CC(=C2F)F)OC)C3=CC=CC=C3

DOS

IR

Vibrations