Geometry & MOs

Info

ID:	285365
PubChem CID:	104102786
Reduced:	NOC5H9 (2)
Stoich.:	ABC5D9 (2)
Weight, g/mol:	232.121178
ΔH_f, kcal/mol:	-58.8
Dipole, Da:	2.19
IP(EA), eV:	-9.18(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-oxazolidin-2-yl(1,2,3,4-tetrahydroisoquinolin-7-yl)methanone

Drug info:

PubChemData

Smile

C1CC(C1)(CC(=O)N2CCCO2)CN

DOS

IR

Vibrations