Geometry & MOs

Info

ID:	170785
PubChem CID:	75280047
Reduced:	N2O3C20H28 (1)
Stoich.:	A2B3C20D28 (1)
Weight, g/mol:	358.225643
ΔH_f, kcal/mol:	-141.32
Dipole, Da:	6.69
IP(EA), eV:	-9.49(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(methoxymethyl)-2-oxo-3,4,4a,5,6,7,8,8a-octahydro-1H-quinolin-7-yl]-4-phenylbutanamide

Drug info:

PubChemData

Smile

COCC1CC(=O)NC2C1CCC(C2)NC(=O)CCC3=CC=CC=C3

DOS

IR

Vibrations