Geometry & MOs

Info

ID:	242554
PubChem CID:	97302035
Reduced:	N3O7C23H35 (1)
Stoich.:	A3B7C23D35 (1)
Weight, g/mol:	273.172879
ΔH_f, kcal/mol:	-295.86
Dipole, Da:	2.05
IP(EA), eV:	-8.67(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C/C(=N/NC(=O)N)/C1=C(C=CC(=C1)OCCCC(C)(C)C(=O)O)OCCCC(C)(C)C(=O)O

DOS

IR

Vibrations