Geometry & MOs

Info

ID:	287939
PubChem CID:	104301421
Reduced:	BrClNOH13C15 (1)
Stoich.:	ABCDE13F15 (1)
Weight, g/mol:	302.082205
ΔH_f, kcal/mol:	-11.77
Dipole, Da:	4.71
IP(EA), eV:	-9.68(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[4-[(Z)-N-hydroxy-C-methylcarbonimidoyl]phenyl]-3-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NCC2=CC(=CC=C2)Br)Cl

DOS

IR

Vibrations