Geometry & MOs

Info

ID:	416962
PubChem CID:	135090917
Reduced:	O2N3C19H27 (1)
Stoich.:	A2B3C19D27 (1)
Weight, g/mol:	340.145678
ΔH_f, kcal/mol:	-63.79
Dipole, Da:	5.66
IP(EA), eV:	-8.76(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N2CCC(CC2)N3C[C@@H]4COC[C@H](C3)NC4=O

DOS

IR

Vibrations