Geometry & MOs

Info

ID:	147408
PubChem CID:	53787064
Reduced:	O5C24H38 (1)
Stoich.:	A5B24C38 (1)
Weight, g/mol:	483.100414
ΔH_f, kcal/mol:	-271.51
Dipole, Da:	6.5
IP(EA), eV:	-9.16(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S)-3-(3-acetyl-4-phenylphenyl)-2-[(2,6-dichlorobenzoyl)amino]propanoate

Drug info:

PubChemData

Smile

CCCCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CCCC)CC(C(=O)O)C(=O)O

DOS

IR

Vibrations