Geometry & MOs

Info

ID:	210431
PubChem CID:	80806037
Reduced:	OSN4C14H24 (1)
Stoich.:	ABC4D14E24 (1)
Weight, g/mol:	235.14331
ΔH_f, kcal/mol:	-26.29
Dipole, Da:	5.48
IP(EA), eV:	-8.33(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-amino-5-methylpyrimidin-4-yl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CCCOC1CCCN(C1)C2=NC(=NC(=C2)NC)SC

DOS

IR

Vibrations