Geometry & MOs

Info

ID:	421064
PubChem CID:	135115307
Reduced:	NO4C19H29 (1)
Stoich.:	AB4C19D29 (1)
Weight, g/mol:	333.194008
ΔH_f, kcal/mol:	-183.6
Dipole, Da:	5.63
IP(EA), eV:	-8.58(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-9-yl)-(2-methoxy-4-methylphenyl)methanone

Drug info:

PubChemData

Smile

CCC[C@@]1(CN(CC[C@@H]1O)CCOC2=C(C=C(C=C2)C)C)C(=O)O

DOS

IR

Vibrations