Geometry & MOs

Info

ID:	423310
PubChem CID:	135119288
Reduced:	O3N4C21H30 (1)
Stoich.:	A3B4C21D30 (1)
Weight, g/mol:	263.168543
ΔH_f, kcal/mol:	-89.19
Dipole, Da:	5.6
IP(EA), eV:	-8.98(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5R)-7-[(4-fluorophenyl)methyl]-7-azaspiro[4.5]decan-4-ol

Drug info:

PubChemData

Smile

CC1=NC=C(N1)CN(CCO)CC2=CC=C(C=C2)OCC(=O)N3CCCCC3

DOS

IR

Vibrations