Geometry & MOs

Info

ID:	391220
PubChem CID:	135003615
Reduced:	ON2F4H18C25 (1)
Stoich.:	AB2C4D18E25 (1)
Weight, g/mol:	440.11479
ΔH_f, kcal/mol:	-101.88
Dipole, Da:	7.33
IP(EA), eV:	-9.54(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S)-N-(4-cyano-2,3,5,6-tetrafluorophenyl)-2-phenyl-1-phenylmethoxycyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C1[C@H]([C@@]1(CCC2=CC=CC=C2)C(=O)NC3=C(C(=C(C(=C3F)F)C#N)F)F)C4=CC=CC=C4

DOS

IR

Vibrations