Geometry & MOs

Info

ID:	195767
PubChem CID:	78732359
Reduced:	O2N4H22C23 (1)
Stoich.:	A2B4C22D23 (1)
Weight, g/mol:	369.033477
ΔH_f, kcal/mol:	17.7
Dipole, Da:	4.21
IP(EA), eV:	-8.67(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2,4-dichloroanilino)-1-oxopropan-2-yl] 2-(3-fluorophenyl)acetate

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)C=CC3=CN(N=C3)C4=CC=CC=C4

DOS

IR

Vibrations