Geometry & MOs

Info

ID:	367968
PubChem CID:	127326174
Reduced:	O3N5C19H31 (1)
Stoich.:	A3B5C19D31 (1)
Weight, g/mol:	385.236542
ΔH_f, kcal/mol:	-137.96
Dipole, Da:	4.23
IP(EA), eV:	-7.98(-0.5)
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]-methylamino]-1-phenylpiperidin-2-one

Drug info:

PubChemData

Smile

CC1CCC(CC1)N2CCN(CC2)CC(=O)C3=C(N(C(=O)N(C3=O)C)C)N

DOS

IR

Vibrations