Geometry & MOs

Info

ID:	272047
PubChem CID:	103721155
Reduced:	ClN2S2O3C12H19 (1)
Stoich.:	AB2C2D3E12F19 (1)
Weight, g/mol:	181.085127
ΔH_f, kcal/mol:	-104.67
Dipole, Da:	5.15
IP(EA), eV:	-9.62(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-3-hydroxypyrrolidin-1-yl]-imidazol-1-ylmethanone

Drug info:

PubChemData

Smile

CCOC1CC(C1(C)C)NS(=O)(=O)C2=C(N=C(S2)Cl)C

DOS

IR

Vibrations