Geometry & MOs

Info

ID:	404427
PubChem CID:	135066282
Reduced:	ClNF2O3C20H20 (1)
Stoich.:	ABC2D3E20F20 (1)
Weight, g/mol:	367.1959
ΔH_f, kcal/mol:	-205.93
Dipole, Da:	2.58
IP(EA), eV:	-9.99(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(1S)-1-cyclohexyl-2,2-difluoro-3-oxo-3-phenylpropyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@@H](C1=CC=CC=C1)C(C(=O)C2=CC=C(C=C2)Cl)(F)F

DOS

IR

Vibrations