Geometry & MOs

Info

ID:	349151
PubChem CID:	127274877
Reduced:	SN3O3C15H27 (1)
Stoich.:	AB3C3D15E27 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-135.02
Dipole, Da:	6.69
IP(EA), eV:	-8.91(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzoyl-N-methyl-N-(2-morpholin-4-ylethyl)-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CCCC(=O)N1CSCC1C(=O)N(C)CCN2CCOCC2

DOS

IR

Vibrations