Geometry & MOs

Info

ID:	200875
PubChem CID:	79457477
Reduced:	N4O5C11H18 (1)
Stoich.:	A4B5C11D18 (1)
Weight, g/mol:	283.105587
ΔH_f, kcal/mol:	-110.55
Dipole, Da:	6.79
IP(EA), eV:	-9.48(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(3,5-dimethoxybenzoyl)amino]ethoxy]acetic acid

Drug info:

PubChemData

Smile

CC(C)C1=NN(C(=C1[N+](=O)[O-])NCCOCC(=O)O)C

DOS

IR

Vibrations