Geometry & MOs

Info

ID:	129706
PubChem CID:	51073609
Reduced:	OSN5C10H13 (1)
Stoich.:	ABC5D10E13 (1)
Weight, g/mol:	347.085911
ΔH_f, kcal/mol:	56.46
Dipole, Da:	4.81
IP(EA), eV:	-9.24(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-2-[[(2-methyl-1-thiophen-2-ylpropyl)amino]methyl]pyrido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

CCCNC(=O)CN1N=C(N=N1)C2=CSC=C2

DOS

IR

Vibrations