Geometry & MOs

Info

ID:	38355
PubChem CID:	8032270
Reduced:	O2N3C20H21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	369.068033
ΔH_f, kcal/mol:	5.8
Dipole, Da:	6.95
IP(EA), eV:	-8.93(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-5-(2-chloro-6-fluorophenyl)-2-phenyl-1,5,6,8-tetrahydropyrido[2,3-d]pyrimidine-4,7-dione

Drug info:

PubChemData

Smile

CN1C=CN=C1CN([C@@H]2CCCC3=CC=CC=C23)C(=O)C4=CC=CO4

DOS

IR

Vibrations