Geometry & MOs

Info

ID:	26342
PubChem CID:	645120
Reduced:	SN2O2C14H16 (1)
Stoich.:	AB2C2D14E16 (1)
Weight, g/mol:	411.20055
ΔH_f, kcal/mol:	-47.97
Dipole, Da:	6.9
IP(EA), eV:	-9.04(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-ethoxypropylamino)-N-(2-morpholin-4-ylphenyl)acetamide;oxalic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC2=CN=CC=C2)C

DOS

IR

Vibrations