Geometry & MOs

Info

ID:	25610
PubChem CID:	627087
Reduced:	O3C21H28 (1)
Stoich.:	A3B21C28 (1)
Weight, g/mol:	598.286529
ΔH_f, kcal/mol:	-132.0
Dipole, Da:	3.53
IP(EA), eV:	-8.96(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(dibenzylamino)-2,2-dimethyl-3-[(4-methylphenyl)sulfonylamino]-5-phenylpentanoate

Drug info:

PubChemData

Smile

CCCCCC1=CC(=C2C3C=C(CCC3C(OC2=C1)(C)C)C=O)O

DOS

IR

Vibrations