Geometry & MOs

Info

ID:	396496
PubChem CID:	135028589
Reduced:	O2C11H12 (1)
Stoich.:	A2B11C12 (1)
Weight, g/mol:	303.147058
ΔH_f, kcal/mol:	16.66
Dipole, Da:	2.25
IP(EA), eV:	-9.41(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-tert-butyl 4-O-phenyl 3,6-dihydro-2H-pyridine-1,4-dicarboxylate

Drug info:

PubChemData

Smile

CC1C=C[C@H](OO1)C2=CC=CC=C2

DOS

IR

Vibrations