Geometry & MOs

Info

ID:	179038
PubChem CID:	76424877
Reduced:	O2N5C18H29 (1)
Stoich.:	A2B5C18D29 (1)
Weight, g/mol:	355.225977
ΔH_f, kcal/mol:	-71.73
Dipole, Da:	6.7
IP(EA), eV:	-9.48(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-aminoethyl)-6-[1-(4-methylphenyl)cyclopropanecarbonyl]-4,4a,5,7,8,8a-hexahydro-3H-1,6-naphthyridin-2-one

Drug info:

PubChemData

Smile

CC(C)CN1C2CCN(CC2CCC1=O)C(=O)CCCN3C=NC=N3

DOS

IR

Vibrations