Geometry & MOs

Info

ID:	366510
PubChem CID:	127320026
Reduced:	SN2O3C18H28 (1)
Stoich.:	AB2C3D18E28 (1)
Weight, g/mol:	374.231791
ΔH_f, kcal/mol:	-133.22
Dipole, Da:	2.44
IP(EA), eV:	-8.85(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-5-oxo-2-pyridin-3-ylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(CC(=O)NCC(C2=CC=CS2)N3CCOCC3)O

DOS

IR

Vibrations