Geometry & MOs

Info

ID:	265135
PubChem CID:	103511262
Reduced:	ON4C6H6 (1)
Stoich.:	AB4C6D6 (1)
Weight, g/mol:	221.116427
ΔH_f, kcal/mol:	33.13
Dipole, Da:	4.28
IP(EA), eV:	-10.31(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-cyclopropyl-3-hydroxyazetidin-1-yl)-(3-methylimidazol-4-yl)methanone

Drug info:

PubChemData

Smile

CN1C=NC=C1C(=O)NC#N

DOS

IR

Vibrations