Geometry & MOs

Info

ID:	363993
PubChem CID:	127313662
Reduced:	NO2C17H27 (1)
Stoich.:	AB2C17D27 (1)
Weight, g/mol:	296.155849
ΔH_f, kcal/mol:	-124.56
Dipole, Da:	5.07
IP(EA), eV:	-9.34(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,3-dimethylpiperidine-1-carbonyl)-7a-methyl-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazol-5-one

Drug info:

PubChemData

Smile

CC1(CCCN(C1)C(=O)C2CC3CCCC(C2)C3=O)C

DOS

IR

Vibrations