Geometry & MOs

Info

ID:	231572
PubChem CID:	87574162
Reduced:	SN2O2C14H14 (1)
Stoich.:	AB2C2D14E14 (1)
Weight, g/mol:	334.119654
ΔH_f, kcal/mol:	-29.68
Dipole, Da:	5.0
IP(EA), eV:	-8.38(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-chloropyridin-3-yl)-4-(2-methoxypropan-2-yloxy)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine

Drug info:

PubChemData

Smile

CC(=O)SOC1=CC=CC(=C1N)C2=CC(=CC=C2)N

DOS

IR

Vibrations