Geometry & MOs

Info

ID:	243355
PubChem CID:	99222708
Reduced:	N2O4C25H32 (1)
Stoich.:	A2B4C25D32 (1)
Weight, g/mol:	424.236208
ΔH_f, kcal/mol:	-153.79
Dipole, Da:	5.69
IP(EA), eV:	-9.12(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-4-(4-ethoxyphenyl)-4-oxo-N-[(1S)-1-(4-propylphenyl)ethyl]butanamide

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)[C@@H](C)N(CC(=O)N)C(=O)CCC(=O)C2=CC=C(C=C2)OCC

DOS

IR

Vibrations