Geometry & MOs

Info

ID:	156976
PubChem CID:	56404283
Reduced:	SO2N5C23H33 (1)
Stoich.:	AB2C5D23E33 (1)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	-36.69
Dipole, Da:	4.03
IP(EA), eV:	-8.82(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-3-[4-(1,3-dioxolan-2-yl)piperidine-1-carbonyl]pyridin-2-one

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2CCN(CC2)C(=O)CSC3=NN=CN3C4=CC=C(C=C4)C

DOS

IR

Vibrations