Geometry & MOs

Info

ID:	207868
PubChem CID:	80463233
Reduced:	ClNOC9H12 (1)
Stoich.:	ABCD9E12 (1)
Weight, g/mol:	286.06808
ΔH_f, kcal/mol:	-13.55
Dipole, Da:	3.27
IP(EA), eV:	-9.65(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-2-ethyl-5-methylpyrazol-3-yl)-1-(1-methylcyclopropyl)ethanol

Drug info:

PubChemData

Smile

CC1CCCC2=C1ON=C2CCl

DOS

IR

Vibrations