Geometry & MOs

Info

ID:	359493
PubChem CID:	127298767
Reduced:	SO2N4C19H32 (1)
Stoich.:	AB2C4D19E32 (1)
Weight, g/mol:	389.213698
ΔH_f, kcal/mol:	-78.23
Dipole, Da:	1.04
IP(EA), eV:	-8.89(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-ethylphenyl)ethyl]-2-[2-(thiomorpholine-4-carbonyl)pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CC(N(C1)CC(=O)NC2CCN(CC2)C3CC3)C(=O)N4CCSCC4

DOS

IR

Vibrations