Geometry & MOs

Info

ID:	249679
PubChem CID:	103091321
Reduced:	N2O2C11H18 (1)
Stoich.:	A2B2C11D18 (1)
Weight, g/mol:	166.110613
ΔH_f, kcal/mol:	-55.44
Dipole, Da:	4.54
IP(EA), eV:	-9.06(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4-(2-methylpyrazol-3-yl)but-3-en-2-ol

Drug info:

PubChemData

Smile

CC1=NN(C(=C1/C=C(/C)\C(C)O)OC)C

DOS

IR

Vibrations