Geometry & MOs

Info

ID:	242555
PubChem CID:	97302043
Reduced:	NO2C17H23 (1)
Stoich.:	AB2C17D23 (1)
Weight, g/mol:	273.172879
ΔH_f, kcal/mol:	-74.41
Dipole, Da:	2.87
IP(EA), eV:	-8.92(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl (3R)-1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CCN1CC=C([C@@H](C1)C(=O)OC(C)C)C2=CC=CC=C2

DOS

IR

Vibrations