Geometry & MOs

Info

ID:	359484
PubChem CID:	127298758
Reduced:	SO2N3C19H33 (1)
Stoich.:	AB2C3D19E33 (1)
Weight, g/mol:	396.219512
ΔH_f, kcal/mol:	-119.37
Dipole, Da:	2.89
IP(EA), eV:	-8.86(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-oxo-1-piperidin-1-ylpropan-2-yl)-2-[2-(thiomorpholine-4-carbonyl)pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CCC(CC1)CCNC(=O)CN2CCCC2C(=O)N3CCSCC3

DOS

IR

Vibrations