Geometry & MOs

Info

ID:	36615
PubChem CID:	8009889
Reduced:	N2O4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	402.157957
ΔH_f, kcal/mol:	-153.65
Dipole, Da:	1.73
IP(EA), eV:	-9.38(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-acetamidoanilino)-2-oxoethyl] 2-(4-phenylphenyl)acetate

Drug info:

PubChemData

Smile

CC[C@@H](C)NC(=O)NC(=O)COC(=O)CC1=CC=C(C=C1)C2=CC=CC=C2

DOS

IR

Vibrations