Geometry & MOs

Info

ID:	343566
PubChem CID:	127266739
Reduced:	ClON4C17H19 (1)
Stoich.:	ABC4D17E19 (1)
Weight, g/mol:	222.111676
ΔH_f, kcal/mol:	29.43
Dipole, Da:	2.35
IP(EA), eV:	-8.86(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-methoxy-3-methylazetidin-1-yl)pyrimidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(=O)C1=C(C=CC=C1Cl)N2CCCN(CC2)C3=NN=CC=C3

DOS

IR

Vibrations