Geometry & MOs

Info

ID:	295293
PubChem CID:	117525220
Reduced:	N4C15H18 (1)
Stoich.:	A4B15C18 (1)
Weight, g/mol:	256.132411
ΔH_f, kcal/mol:	65.41
Dipole, Da:	9.51
IP(EA), eV:	-8.5(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CNC1=CN2C(=C(N=C2C3CCCCC3)C#N)C=C1

DOS

IR

Vibrations