Geometry & MOs

Info

ID:	324092
PubChem CID:	126676909
Reduced:	NOC10H17 (1)
Stoich.:	ABC10D17 (1)
Weight, g/mol:	403.091258
ΔH_f, kcal/mol:	-54.67
Dipole, Da:	1.51
IP(EA), eV:	-7.93(1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-tert-butyl 5-O-methyl 2-methyl-4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridine-1,5-dicarboxylate

Drug info:

PubChemData

Smile

CC1CCNC2=C1C(CCO2)C

DOS

IR

Vibrations