Geometry & MOs

Info

ID:	272056
PubChem CID:	103721954
Reduced:	BrClNOC13H15 (1)
Stoich.:	ABCDE13F15 (1)
Weight, g/mol:	296.119464
ΔH_f, kcal/mol:	-38.52
Dipole, Da:	3.74
IP(EA), eV:	-9.63(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-methylcyclopropyl)methyl]-3-(4-sulfamoylphenyl)propanamide

Drug info:

PubChemData

Smile

CCC1(CCC1)NC(=O)C2=C(C=CC(=C2)Cl)Br

DOS

IR

Vibrations