Geometry & MOs

Info

ID:	243923
PubChem CID:	99300605
Reduced:	ClN2O3C22H25 (1)
Stoich.:	AB2C3D22E25 (1)
Weight, g/mol:	365.058549
ΔH_f, kcal/mol:	-88.93
Dipole, Da:	4.69
IP(EA), eV:	-8.64(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-acetamidophenyl) 2-(3,4-dichlorophenyl)-2-methylpropanoate

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCOC3=CC=CC=C3Cl

DOS

IR

Vibrations