Geometry & MOs

Info

ID:	305414
PubChem CID:	124807171
Reduced:	S2N3O4C13H19 (1)
Stoich.:	A2B3C4D13E19 (1)
Weight, g/mol:	293.156184
ΔH_f, kcal/mol:	-132.66
Dipole, Da:	6.67
IP(EA), eV:	-9.36(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R,10S)-10-ethyl-9-[(4-methyl-1,3-thiazol-5-yl)methyl]-1,9-diazaspiro[4.5]decan-2-one

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C(=O)N2CC[C@@H]3[C@@H](C2)N(CCO3)S(=O)(=O)C

DOS

IR

Vibrations