Geometry & MOs

Info

ID:	174084
PubChem CID:	75721568
Reduced:	Cl2N2O3H24C25 (1)
Stoich.:	A2B2C3D24E25 (1)
Weight, g/mol:	470.116398
ΔH_f, kcal/mol:	-74.37
Dipole, Da:	6.05
IP(EA), eV:	-8.93(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(tert-butylamino)-1-(4-hydroxyphenyl)-2-oxoethyl]-3-chloro-N-(2-chlorophenyl)benzamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C(C1=CC(=CC=C1)O)N(C2=CC=CC=C2Cl)C(=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations