Geometry & MOs

Info

ID:	416197
PubChem CID:	135089207
Reduced:	O2N4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	339.1646
ΔH_f, kcal/mol:	-26.97
Dipole, Da:	7.68
IP(EA), eV:	-9.28(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-difluorophenoxy)-1-[(4R,5S)-4-methoxy-7-azaspiro[4.5]decan-7-yl]ethanone

Drug info:

PubChemData

Smile

CN1C=C(N=C1)C(=O)N2C[C@H]([C@H](C2)O)CC3=CC=NC=C3

DOS

IR

Vibrations