Geometry & MOs

Info

ID:	187695
PubChem CID:	77611879
Reduced:	N2O5C35H36 (1)
Stoich.:	A2B5C35D36 (1)
Weight, g/mol:	620.325023
ΔH_f, kcal/mol:	-119.03
Dipole, Da:	4.09
IP(EA), eV:	-8.68(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(2-benzoylanilino)-3-[4-[2-(8-phenyloctanoylamino)ethoxy]phenyl]propanoate

Drug info:

PubChemData

Smile

CCCC(=O)N(CCOC1=CC=C(C=C1)CC(C(=O)OC)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations