Geometry & MOs

Info

ID:	343448
PubChem CID:	127266621
Reduced:	O2N5C17H25 (1)
Stoich.:	A2B5C17D25 (1)
Weight, g/mol:	246.100442
ΔH_f, kcal/mol:	-44.75
Dipole, Da:	4.19
IP(EA), eV:	-9.0(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(pyridine-3-carbonyl)-3,6-dihydro-2H-pyridine-5-carboxylate

Drug info:

PubChemData

Smile

CC1=NN2C(=C(C=NC2=C1)C(=O)NC[C@H](CN3CCCCC3)O)C

DOS

IR

Vibrations