Geometry & MOs

Info

ID:	324771
PubChem CID:	126678311
Reduced:	N2O6C27H36 (1)
Stoich.:	A2B6C27D36 (1)
Weight, g/mol:	486.272987
ΔH_f, kcal/mol:	-272.34
Dipole, Da:	5.33
IP(EA), eV:	-9.0(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-tert-butyl 3-O-ethyl (2R,3R,4R)-2-methyl-4-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-6-yl]piperidine-1,3-dicarboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(CCN(C1C)C(=O)OC(C)(C)C)C2=CC3=C(C=C2)C=CN3C(=O)OC(C)(C)C

DOS

IR

Vibrations