Geometry & MOs

Info

ID:	295294
PubChem CID:	117525352
Reduced:	ON4C14H16 (1)
Stoich.:	AB4C14D16 (1)
Weight, g/mol:	267.173548
ΔH_f, kcal/mol:	16.89
Dipole, Da:	1.12
IP(EA), eV:	-8.78(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-[2-(2-methylphenyl)ethyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C2=NC3=C(CNCC3)C(=N2)N

DOS

IR

Vibrations