Geometry & MOs

Info

ID:	253724
PubChem CID:	103120221
Reduced:	O2N3C15H19 (1)
Stoich.:	A2B3C15D19 (1)
Weight, g/mol:	221.116427
ΔH_f, kcal/mol:	-25.49
Dipole, Da:	4.79
IP(EA), eV:	-8.81(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-cyclopropyl-3-hydroxyazetidin-1-yl)-(1-methylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CCCC1(CN(C1)C(=O)C2=NN(C3=CC=CC=C32)C)O

DOS

IR

Vibrations