Geometry & MOs

Info

ID:	332072
PubChem CID:	127250358
Reduced:	ON6C19H24 (1)
Stoich.:	AB6C19D24 (1)
Weight, g/mol:	409.146013
ΔH_f, kcal/mol:	61.34
Dipole, Da:	2.23
IP(EA), eV:	-8.72(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[5-(3-methoxyphenyl)pyridin-2-yl]morpholin-4-yl]-2-(2-methyl-1,3-thiazol-4-yl)ethanone

Drug info:

PubChemData

Smile

CCN1C=C(C(=N1)C)CN2CCOC(C2)C3=NC=C(C=C3)C4=CC=NN4

DOS

IR

Vibrations