Geometry & MOs

Info

ID:	156108
PubChem CID:	56369155
Reduced:	N3O5C17H27 (1)
Stoich.:	A3B5C17D27 (1)
Weight, g/mol:	433.095997
ΔH_f, kcal/mol:	-204.31
Dipole, Da:	3.07
IP(EA), eV:	-8.8(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dichloro-N-[2-[[1-(cyclopropylamino)-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)CN(CCN(C)C)C(=O)CNC(=O)C1=COC=C1

DOS

IR

Vibrations