Geometry & MOs

Info

ID:	261165
PubChem CID:	103220862
Reduced:	BrClINOSH10C13 (1)
Stoich.:	ABCDEFG10H13 (1)
Weight, g/mol:	350.98869
ΔH_f, kcal/mol:	34.1
Dipole, Da:	3.87
IP(EA), eV:	-9.52(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-iodo-N-pentan-2-ylbenzamide

Drug info:

PubChemData

Smile

CN(CC1=CSC(=C1)Br)C(=O)C2=CC(=C(C=C2)I)Cl

DOS

IR

Vibrations