Geometry & MOs

Info

ID:	355714
PubChem CID:	127289787
Reduced:	O2N5C22H29 (1)
Stoich.:	A2B5C22D29 (1)
Weight, g/mol:	352.201159
ΔH_f, kcal/mol:	-14.16
Dipole, Da:	8.75
IP(EA), eV:	-8.84(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-(6-piperidin-1-ylpyridin-3-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CN3CCC4=CN=CN=C4C3

DOS

IR

Vibrations