Geometry & MOs

Info

ID:	331980
PubChem CID:	127250266
Reduced:	OSN3C21H23 (1)
Stoich.:	ABC3D21E23 (1)
Weight, g/mol:	379.171834
ΔH_f, kcal/mol:	37.56
Dipole, Da:	2.58
IP(EA), eV:	-8.91(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC=C(S1)CN2CCOC(C2)C3=NC=C(C=C3)CC4=CC=CC=C4

DOS

IR

Vibrations