Geometry & MOs

Info

ID:	361953
PubChem CID:	127304949
Reduced:	SN3O3C16H31 (1)
Stoich.:	AB3C3D16E31 (1)
Weight, g/mol:	320.221226
ΔH_f, kcal/mol:	-158.39
Dipole, Da:	4.12
IP(EA), eV:	-8.51(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-2-(2-oxopyrimidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CCC1CCCN(C1)C(C)(C)CNC(=O)CN2CCCS2(=O)=O

DOS

IR

Vibrations