Geometry & MOs

Info

ID:	155328
PubChem CID:	56352916
Reduced:	Cl2N3O3C25H29 (1)
Stoich.:	A2B3C3D25E29 (1)
Weight, g/mol:	424.247441
ΔH_f, kcal/mol:	-106.03
Dipole, Da:	3.16
IP(EA), eV:	-8.79(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-methoxyanilino)pyridin-3-yl]-[4-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CN(CCC1CCN2CCOCC2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC(=CC(=C4)Cl)Cl

DOS

IR

Vibrations