Geometry & MOs

Info

ID:	333341
PubChem CID:	127251893
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	438.237939
ΔH_f, kcal/mol:	1.69
Dipole, Da:	5.92
IP(EA), eV:	-9.09(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)N1CCC(C1)C2=NC3=C(CCN(C3)CCC4=CC=CC=C4)C(=N2)NC

DOS

IR

Vibrations