Geometry & MOs

Info

ID:	171775
PubChem CID:	75425458
Reduced:	NSCl2O3H15C17 (1)
Stoich.:	ABC2D3E15F17 (1)
Weight, g/mol:	264.183778
ΔH_f, kcal/mol:	-68.16
Dipole, Da:	7.4
IP(EA), eV:	-9.78(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-4-(3-hydroxypropylamino)-3-methylbenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations