Geometry & MOs

Info

ID:	390104
PubChem CID:	134997100
Reduced:	FNOH18C21 (1)
Stoich.:	ABCD18E21 (1)
Weight, g/mol:	365.199094
ΔH_f, kcal/mol:	-8.53
Dipole, Da:	4.74
IP(EA), eV:	-8.71(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-3-methyl-2-[[(Z)-3-oxo-1,5-diphenylpent-4-enyl]amino]butanoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)NC3=CC=CC=C3F

DOS

IR

Vibrations