Geometry & MOs

Info

ID:	418991
PubChem CID:	135107285
Reduced:	ON2C7H11 (2)
Stoich.:	AB2C7D11 (2)
Weight, g/mol:	354.134635
ΔH_f, kcal/mol:	-72.74
Dipole, Da:	4.78
IP(EA), eV:	-9.46(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5S)-N-(3-chlorophenyl)-4,5-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1CC(CC1=O)NC(=O)CCCN2C=CC=N2

DOS

IR

Vibrations