Geometry & MOs

Info

ID:	21088
PubChem CID:	587144
Reduced:	ClNO5H16C17 (1)
Stoich.:	ABC5D16E17 (1)
Weight, g/mol:	349.0717
ΔH_f, kcal/mol:	-165.32
Dipole, Da:	4.67
IP(EA), eV:	-8.83(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4-chlorobenzoyl)amino]-4,5-dimethoxybenzoate

Drug info:

PubChemData

Smile

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)Cl)OC

DOS

IR

Vibrations