Geometry & MOs

Info

ID:	345821
PubChem CID:	127270121
Reduced:	O3N4C21H36 (1)
Stoich.:	A3B4C21D36 (1)
Weight, g/mol:	395.224263
ΔH_f, kcal/mol:	-175.83
Dipole, Da:	9.52
IP(EA), eV:	-8.96(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyl-N-[2-oxo-2-[[4-(thiomorpholine-4-carbonyl)cyclohexyl]amino]ethyl]acetamide

Drug info:

PubChemData

Smile

CCCC(=O)NCC1CCCN(C1)C(=O)C2CCCN(C2)C(=O)N3CCCC3

DOS

IR

Vibrations