Geometry & MOs

Info

ID:	60810
PubChem CID:	26702418
Reduced:	N2O3H16C17 (1)
Stoich.:	A2B3C16D17 (1)
Weight, g/mol:	425.103
ΔH_f, kcal/mol:	-54.69
Dipole, Da:	8.76
IP(EA), eV:	-9.07(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2-chlorobenzoyl)amino]phenyl] 2-(2,4-dimethoxyphenyl)acetate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)CC(=O)NC2=CC=C(C=C2)C#N)OC

DOS

IR

Vibrations