Geometry & MOs

Info

ID:	420103
PubChem CID:	135111157
Reduced:	ON5C23H25 (1)
Stoich.:	AB5C23D25 (1)
Weight, g/mol:	374.161741
ΔH_f, kcal/mol:	27.38
Dipole, Da:	7.68
IP(EA), eV:	-8.1(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5R)-N-[4-fluoro-3-(trifluoromethyl)phenyl]-4-methoxy-7-azaspiro[4.5]decane-7-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=N/C(=C/2\C=CC=CC2=O)/N1)N3CCCC4(C3)CCC5=CN=C(N=C45)C

DOS

IR

Vibrations