Geometry & MOs

Info

ID:	422762
PubChem CID:	135118365
Reduced:	FO2N3C14H14 (1)
Stoich.:	AB2C3D14E14 (1)
Weight, g/mol:	364.23262
ΔH_f, kcal/mol:	-52.24
Dipole, Da:	2.07
IP(EA), eV:	-9.02(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5R)-7-[1-(3,4-difluorophenyl)piperidin-4-yl]-4-methoxy-7-azaspiro[4.5]decane

Drug info:

PubChemData

Smile

COC1=NC(=NC=C1F)N2CCOC3=CC=CC=C3C2

DOS

IR

Vibrations