Geometry & MOs

Info

ID:	417910
PubChem CID:	135103045
Reduced:	O2N3C15H23 (1)
Stoich.:	A2B3C15D23 (1)
Weight, g/mol:	364.199822
ΔH_f, kcal/mol:	-39.84
Dipole, Da:	3.87
IP(EA), eV:	-8.81(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5S)-4,5-dihydroxy-N-(4-methoxy-2-methylphenyl)-4-methyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide

Drug info:

PubChemData

Smile

CCCC1=NC(=NO1)N2CCC3(CC2)C=C(CCO3)C

DOS

IR

Vibrations