Geometry & MOs

Info

ID:	422824
PubChem CID:	135118478
Reduced:	N6C19H24 (1)
Stoich.:	A6B19C24 (1)
Weight, g/mol:	342.114648
ΔH_f, kcal/mol:	90.46
Dipole, Da:	4.56
IP(EA), eV:	-8.62(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-6-fluoro-N-[[1-(2-methoxyethyl)-5-oxopyrrolidin-3-yl]methyl]-3-methylbenzamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2N=C1C3CCN(CC3)C4=NC=CN=C4N(C)C

DOS

IR

Vibrations