Geometry & MOs

Info

ID:	17817
PubChem CID:	521842
Reduced:	ClON2H11C13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	246.055991
ΔH_f, kcal/mol:	4.26
Dipole, Da:	3.04
IP(EA), eV:	-8.03(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chlorophenyl)-(2,5-diaminophenyl)methanone

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)N)N)Cl

DOS

IR

Vibrations