Geometry & MOs

Info

ID:	73625
PubChem CID:	48419536
Reduced:	SN3O6C17H17 (1)
Stoich.:	AB3C6D17E17 (1)
Weight, g/mol:	397.236542
ΔH_f, kcal/mol:	-106.8
Dipole, Da:	4.63
IP(EA), eV:	-9.01(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2,6-dimethylmorpholine-4-carbonyl)piperidin-1-yl]-2-(1-methylindol-3-yl)ethanone

Drug info:

PubChemData

Smile

CNC(=O)COC1=CC=CC(=C1)NC(=O)CS(=O)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations