Geometry & MOs

Info

ID:	156992
PubChem CID:	56404723
Reduced:	NO2C9H11 (2)
Stoich.:	AB2C9D11 (2)
Weight, g/mol:	441.237604
ΔH_f, kcal/mol:	-102.46
Dipole, Da:	4.07
IP(EA), eV:	-9.36(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-6-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidine-1-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1CN(CCC1C2OCCO2)C(=O)C3=NOC(C3)C4=CC=CC=C4

DOS

IR

Vibrations