Geometry & MOs

Info

ID:	36591
PubChem CID:	8009277
Reduced:	NCl2O4C19H19 (1)
Stoich.:	AB2C4D19E19 (1)
Weight, g/mol:	357.157623
ΔH_f, kcal/mol:	-149.09
Dipole, Da:	5.7
IP(EA), eV:	-9.28(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl] 3-methoxybenzoate

Drug info:

PubChemData

Smile

C[C@H](C1=C(C=C(C=C1)Cl)Cl)NC(=O)[C@H](C)OC(=O)C2=CC(=CC=C2)OC

DOS

IR

Vibrations