Geometry & MOs

Info

ID:	323975
PubChem CID:	126676703
Reduced:	N4C11H16 (2)
Stoich.:	A4B11C16 (2)
Weight, g/mol:	257.105193
ΔH_f, kcal/mol:	80.43
Dipole, Da:	2.67
IP(EA), eV:	-8.26(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-oxo-1-[(1R)-1-phenylethyl]pyridine-3-carboxylate

Drug info:

PubChemData

Smile

C1CNCCC1CC2=CC(=CC=C2)CN=C/C(=C\N)/CC3=CC(=NC(=C3N)NN)N

DOS

IR

Vibrations