Geometry & MOs

Info

ID:	306062
PubChem CID:	125001506
Reduced:	ON2C27H32 (1)
Stoich.:	AB2C27D32 (1)
Weight, g/mol:	291.183444
ΔH_f, kcal/mol:	5.48
Dipole, Da:	3.97
IP(EA), eV:	-8.82(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-9-[(4-methoxyphenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-5-ol

Drug info:

PubChemData

Smile

C1CCC2(CC1)[C@@H]3CN(C[C@@H]3CN2C(=O)/C=C/C4=CC=CC=C4)CC5=CC=CC=C5

DOS

IR

Vibrations