Geometry & MOs

Info

ID:	296221
PubChem CID:	117561341
Reduced:	ClN4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	254.153147
ΔH_f, kcal/mol:	10.32
Dipole, Da:	4.11
IP(EA), eV:	-9.14(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dimethylphenyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC(C)CNC1=NC(=NC2=C1CNCC2)Cl

DOS

IR

Vibrations