Geometry & MOs

Info

ID:

331830

PubChem CID:

127250116

Reduced:

O3N5C25H31 (1)

Stoich.:

A3B5C25D31 (1)

Weight, g/mol:

365.156184

ΔHf, kcal/mol:

-54.33

Dipole, Da:

2.05

IP(EA), eV:

-8.67(-0.3)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(6-benzylpyridin-2-yl)-4-[(2-methyl-1,3-thiazol-5-yl)methyl]morpholine

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC2=NC(=CC=C2)C3CN(CCO3)C(=O)CC4=NC(=NN4)C(C)C

DOS

IR

Vibrations