Geometry & MOs

Info

ID:	305769
PubChem CID:	124968798
Reduced:	SO2N3C14H23 (1)
Stoich.:	AB2C3D14E23 (1)
Weight, g/mol:	297.151098
ΔH_f, kcal/mol:	-83.72
Dipole, Da:	4.4
IP(EA), eV:	-8.94(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R)-3-[(dimethylamino)methyl]-3-hydroxypyrrolidin-1-yl]-2-(2,4-dimethyl-1,3-thiazol-5-yl)ethanone

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C)CC(=O)N2CC[C@@](C2)(CN(C)C)O

DOS

IR

Vibrations