Geometry & MOs

Info

ID:	265136
PubChem CID:	103511352
Reduced:	O2N3C11H15 (1)
Stoich.:	A2B3C11D15 (1)
Weight, g/mol:	211.095691
ΔH_f, kcal/mol:	-22.8
Dipole, Da:	1.61
IP(EA), eV:	-9.68(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4S)-3,4-dihydroxypyrrolidin-1-yl]-(3-methylimidazol-4-yl)methanone

Drug info:

PubChemData

Smile

CN1C=NC=C1C(=O)N2CC(C2)(C3CC3)O

DOS

IR

Vibrations