Geometry & MOs

Info

ID:	81055
PubChem CID:	49854295
Reduced:	ON3C12H25 (1)
Stoich.:	AB3C12D25 (1)
Weight, g/mol:	410.156575
ΔH_f, kcal/mol:	-70.23
Dipole, Da:	2.97
IP(EA), eV:	-9.09(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8S)-9-(4-methoxyphenyl)-2-morpholin-4-yl-8-(trifluoromethyl)-7,8-dihydro-6H-pyrimido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

CCC(CC)NC(=O)CN1CCCNCC1

DOS

IR

Vibrations