Geometry & MOs

Info

ID:	264756
PubChem CID:	103488998
Reduced:	NO5C14H21 (1)
Stoich.:	AB5C14D21 (1)
Weight, g/mol:	257.081871
ΔH_f, kcal/mol:	-212.88
Dipole, Da:	1.98
IP(EA), eV:	-8.96(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethoxypropan-2-yl 4-amino-2-chlorobenzoate

Drug info:

PubChemData

Smile

CCOCC(C)OC(=O)C(CC1=CC(=C(C=C1)O)O)N

DOS

IR

Vibrations