Geometry & MOs

Info

ID:	296368
PubChem CID:	117570243
Reduced:	NOC11H15 (1)
Stoich.:	ABC11D15 (1)
Weight, g/mol:	245.037419
ΔH_f, kcal/mol:	-30.79
Dipole, Da:	1.6
IP(EA), eV:	-8.35(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,3-dichloroanilino)pentan-2-one

Drug info:

PubChemData

Smile

CC(=O)CCCNC1=CC=CC=C1

DOS

IR

Vibrations