Geometry & MOs

Info

ID:	233966
PubChem CID:	92297443
Reduced:	ON4C8H8 (1)
Stoich.:	AB4C8D8 (1)
Weight, g/mol:	178.085461
ΔH_f, kcal/mol:	29.73
Dipole, Da:	2.55
IP(EA), eV:	-9.71(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-2-amino-5-methyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one

Drug info:

PubChemData

Smile

C[C@@H]1CC(=C(NC1=O)NC#N)C#N

DOS

IR

Vibrations