Geometry & MOs

Info

ID:	305663
PubChem CID:	124964527
Reduced:	FON4C20H21 (1)
Stoich.:	ABC4D20E21 (1)
Weight, g/mol:	344.119464
ΔH_f, kcal/mol:	-12.73
Dipole, Da:	4.42
IP(EA), eV:	-8.96(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-benzyl-N-[(3R)-1,1-dioxothiolan-3-yl]-N-methylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NC=N1)N2CCC[C@H](C2)C3=NC=C(O3)CC4=CC(=CC=C4)F

DOS

IR

Vibrations