Geometry & MOs

Info

ID:	53313
PubChem CID:	14710305
Reduced:	NO2F3H22C23 (1)
Stoich.:	AB2C3D22E23 (1)
Weight, g/mol:	401.160263
ΔH_f, kcal/mol:	-163.29
Dipole, Da:	5.05
IP(EA), eV:	-8.71(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(4aS,9aR)-1,4,4b,9a-tetrahydrofluoren-4a-yl]-3,3,3-trifluoro-2-methoxy-2-phenylpropanamide

Drug info:

PubChemData

Smile

CO[C@@](C1=CC=CC=C1)(C(=O)N[C@]23CC=CC[C@H]2C=C4C3C=CC=C4)C(F)(F)F

DOS

IR

Vibrations