Geometry & MOs

Info

ID:	60811
PubChem CID:	26702422
Reduced:	ClNO5H20C23 (1)
Stoich.:	ABC5D20E23 (1)
Weight, g/mol:	421.152537
ΔH_f, kcal/mol:	-141.71
Dipole, Da:	2.38
IP(EA), eV:	-8.62(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)CC(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3Cl)OC

DOS

IR

Vibrations