Geometry & MOs

Info

ID:	417965
PubChem CID:	135103182
Reduced:	N2O2C10H11 (2)
Stoich.:	A2B2C10D11 (2)
Weight, g/mol:	307.194757
ΔH_f, kcal/mol:	-89.65
Dipole, Da:	6.88
IP(EA), eV:	-9.52(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[(4-fluoro-3-methylphenyl)methyl]-4-methyl-1-oxa-9-azaspiro[5.5]undecan-4-ol

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@H]2O)C(=O)CCC3=NC4=CC=CC=C4NC3=O

DOS

IR

Vibrations