Geometry & MOs

Info

ID:	155186
PubChem CID:	56320986
Reduced:	N3O5H25C27 (1)
Stoich.:	A3B5C25D27 (1)
Weight, g/mol:	411.215806
ΔH_f, kcal/mol:	-133.2
Dipole, Da:	3.43
IP(EA), eV:	-9.47(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[3-[(3-hydroxybenzoyl)amino]propylamino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCCNC(=O)C4=CC(=CC=C4)O

DOS

IR

Vibrations