Geometry & MOs

Info

ID:	265801
PubChem CID:	103547602
Reduced:	O2C5H7 (2)
Stoich.:	A2B5C7 (2)
Weight, g/mol:	290.0266
ΔH_f, kcal/mol:	-152.62
Dipole, Da:	1.48
IP(EA), eV:	-9.42(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromo-2-ethylpyrazol-3-yl)-2-(1,3-dioxolan-2-yl)ethanol

Drug info:

PubChemData

Smile

C1COC(O1)CC(CC2=COC=C2)O

DOS

IR

Vibrations