Geometry & MOs

Info

ID:	150199
PubChem CID:	53789886
Reduced:	NOC7H9 (1)
Stoich.:	ABC7D9 (1)
Weight, g/mol:	379.171834
ΔH_f, kcal/mol:	-13.92
Dipole, Da:	4.6
IP(EA), eV:	-9.55(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-1-[2-phenyl-4-(1,3-thiazol-5-ylmethyl)-1,3-oxazinan-6-yl]ethanamine

Drug info:

PubChemData

Smile

C1CN2C=CC1CC2=O

DOS

IR

Vibrations