Geometry & MOs

Info

ID:	24
PubChem CID:	1973
Reduced:	BrON6H19C22 (1)
Stoich.:	ABC6D19E22 (1)
Weight, g/mol:	462.08037
ΔH_f, kcal/mol:	90.79
Dipole, Da:	4.14
IP(EA), eV:	-8.66(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-bromophenyl)-7-(6-morpholin-4-ylpyridin-3-yl)pyrido[2,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

C1COCCN1C2=NC=C(C=C2)C3=NC4=NC=NC(=C4C(=C3)C5=CC(=CC=C5)Br)N

DOS

IR

Vibrations