Geometry & MOs

Info

ID:	314234
PubChem CID:	126620977
Reduced:	FN6O6C22H25 (1)
Stoich.:	AB6C6D22E25 (1)
Weight, g/mol:	313.153875
ΔH_f, kcal/mol:	-242.32
Dipole, Da:	10.9
IP(EA), eV:	-9.04(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[(6R)-2-amino-4-oxo-5,6,7,8-tetrahydro-1H-pyrido[2,3-d]pyrimidin-6-yl]ethyl]benzamide

Drug info:

PubChemData

Smile

CC(C)(CCC1=CC(=C(N=C1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)F)C2=CC3=C(N2)NC(=NC3=O)N

DOS

IR

Vibrations