Geometry & MOs

Info

ID:	32735
PubChem CID:	7847544
Reduced:	BrN2O3C19H21 (1)
Stoich.:	AB2C3D19E21 (1)
Weight, g/mol:	384.135508
ΔH_f, kcal/mol:	-81.1
Dipole, Da:	5.49
IP(EA), eV:	-8.82(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-methoxyethylamino)-2-oxoethyl] 2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)CN(C)C(=O)COC2=CC=CC=C2Br

DOS

IR

Vibrations