Geometry & MOs

Info

ID:	60444
PubChem CID:	26686368
Reduced:	NSO5C23H23 (1)
Stoich.:	ABC5D23E23 (1)
Weight, g/mol:	422.103335
ΔH_f, kcal/mol:	-143.8
Dipole, Da:	5.66
IP(EA), eV:	-8.63(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(4-chlorobenzoyl)amino]phenyl] 2-[(2-phenylacetyl)amino]acetate

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C=CC(=C2)OC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations