Geometry & MOs

Info

ID:	331981
PubChem CID:	127250267
Reduced:	OSN3C22H25 (1)
Stoich.:	ABC3D22E25 (1)
Weight, g/mol:	409.182398
ΔH_f, kcal/mol:	30.47
Dipole, Da:	3.57
IP(EA), eV:	-9.04(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[(2-ethoxyphenyl)methyl]pyridin-2-yl]-4-[(2-methyl-1,3-thiazol-5-yl)methyl]morpholine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC2=CN=C(C=C2)C3CN(CCO3)CC4=CN=C(S4)C

DOS

IR

Vibrations