Geometry & MOs

Info

ID:	360643
PubChem CID:	127301288
Reduced:	SN3O4C14H19 (1)
Stoich.:	AB3C4D14E19 (1)
Weight, g/mol:	303.158292
ΔH_f, kcal/mol:	-129.51
Dipole, Da:	8.68
IP(EA), eV:	-9.45(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[[4-(hydroxymethyl)oxan-4-yl]amino]methyl]-7-methylpyrido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

C1COCCC1(CO)NCC2=NS(=O)(=O)C3=CC=CC=C3N2

DOS

IR

Vibrations