Geometry & MOs

Info

ID:	244893
PubChem CID:	99431549
Reduced:	N2F3O3C20H21 (1)
Stoich.:	A2B3C3D20E21 (1)
Weight, g/mol:	395.170828
ΔH_f, kcal/mol:	-259.0
Dipole, Da:	2.25
IP(EA), eV:	-9.58(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]-N-[(3R)-4,4,4-trifluoro-3-hydroxy-3-phenylbutyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NCC(=O)NCC[C@](C2=CC=CC=C2)(C(F)(F)F)O

DOS

IR

Vibrations