Geometry & MOs

Info

ID:	151134
PubChem CID:	53790832
Reduced:	NO7C17H29 (1)
Stoich.:	AB7C17D29 (1)
Weight, g/mol:	250.050905
ΔH_f, kcal/mol:	-345.08
Dipole, Da:	3.01
IP(EA), eV:	-9.24(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-chloro-5-(1,3-dioxolan-2-yl)phenyl]pyrazole

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCCC1CCC(C(=O)OC)(C(=O)OC)O

DOS

IR

Vibrations