Geometry & MOs

Info

ID:	156204
PubChem CID:	56369523
Reduced:	BrN2O3C18H23 (1)
Stoich.:	AB2C3D18E23 (1)
Weight, g/mol:	413.162057
ΔH_f, kcal/mol:	-102.5
Dipole, Da:	1.46
IP(EA), eV:	-9.18(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[5-(dimethylsulfamoyl)-2-morpholin-4-ylbenzoyl]-methylamino]acetate

Drug info:

PubChemData

Smile

CCN1C=C(C=C1C(=O)NCC(COC2=C(C=CC=C2C)C)O)Br

DOS

IR

Vibrations