Geometry & MOs

Info

ID:	361958
PubChem CID:	127304954
Reduced:	SO2N3C19H33 (1)
Stoich.:	AB2C3D19E33 (1)
Weight, g/mol:	336.216141
ΔH_f, kcal/mol:	-128.95
Dipole, Da:	4.16
IP(EA), eV:	-8.51(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-1-methyl-2,4-dioxopyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCN(C1)C(C)(C)CNC(=O)C2CSC3(N2C(=O)CC3)C

DOS

IR

Vibrations