Geometry & MOs

Info

ID:	360696
PubChem CID:	127301341
Reduced:	O2N6C17H26 (1)
Stoich.:	A2B6C17D26 (1)
Weight, g/mol:	385.236542
ΔH_f, kcal/mol:	47.58
Dipole, Da:	3.74
IP(EA), eV:	-8.57(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-(2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl)-2-oxoethyl]-ethylamino]-1-phenylpyrrolidin-2-one

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC(=NO1)CN2CCN(CC2)CC3=NOC(=N3)C4CC4

DOS

IR

Vibrations