Geometry & MOs

Info

ID:	147319
PubChem CID:	53786975
Reduced:	SN2O2C13H14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	281.12766
ΔH_f, kcal/mol:	-15.44
Dipole, Da:	4.31
IP(EA), eV:	-9.09(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2,4-diamino-7-(4-methylphenyl)pyrido[2,3-d]pyrimidin-6-yl]methanol

Drug info:

PubChemData

Smile

C1C(OCS1)COC2=CC=C(C=C2)N3C=CN=C3

DOS

IR

Vibrations