Geometry & MOs

Info

ID:	321039
PubChem CID:	126664503
Reduced:	ClFN2O2C16H16 (1)
Stoich.:	ABC2D2E16F16 (1)
Weight, g/mol:	468.273656
ΔH_f, kcal/mol:	-89.31
Dipole, Da:	1.72
IP(EA), eV:	-9.72(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-oxo-1-[2-[(2S)-3-phenyl-2-(propan-2-ylamino)propanoyl]hydrazinyl]-3-(4-propan-2-yloxyphenyl)propan-2-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)OC1=NC=C(C=N1)[C@@H](CC(=O)Cl)C2=CC=C(C=C2)F

DOS

IR

Vibrations