Geometry & MOs

Info

ID:	50039
PubChem CID:	11538950
Reduced:	S2N3O4C19H19 (1)
Stoich.:	A2B3C4D19E19 (1)
Weight, g/mol:	418.179361
ΔH_f, kcal/mol:	-83.86
Dipole, Da:	2.3
IP(EA), eV:	-8.74(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-anilino-8-ethyl-6-(4-phenylphenyl)pyrido[2,3-d]pyrimidin-7-one

Drug info:

PubChemData

Smile

CCNS(=O)(=O)C1C(=O)C(=CS1)NC(=O)NC2=CC=CC=C2C3=CC=CC=C3

DOS

IR

Vibrations