Geometry & MOs

Info

ID:	154902
PubChem CID:	56314450
Reduced:	ClN2O2C21H25 (1)
Stoich.:	AB2C2D21E25 (1)
Weight, g/mol:	366.230728
ΔH_f, kcal/mol:	-74.34
Dipole, Da:	1.59
IP(EA), eV:	-9.53(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[3-methyl-1-oxo-1-(3-phenylbutylamino)butan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC(CCNC(=O)CCCNC(=O)C1=CC=C(C=C1)Cl)C2=CC=CC=C2

DOS

IR

Vibrations