Geometry & MOs

Info

ID:	343010
PubChem CID:	127266173
Reduced:	NO4C18H23 (1)
Stoich.:	AB4C18D23 (1)
Weight, g/mol:	288.147393
ΔH_f, kcal/mol:	-144.09
Dipole, Da:	4.98
IP(EA), eV:	-8.89(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C(=O)C)CN2CCC=C(C2)C(=O)OC

DOS

IR

Vibrations