Geometry & MOs

Info

ID:	199027
PubChem CID:	79190009
Reduced:	OC7H10 (2)
Stoich.:	AB7C10 (2)
Weight, g/mol:	150.079313
ΔH_f, kcal/mol:	-84.19
Dipole, Da:	3.21
IP(EA), eV:	-8.7(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-(1-methylpyrazol-3-yl)prop-2-en-1-one

Drug info:

PubChemData

Smile

CC(C)OC1=CC=CC(=C1)C(C=C(C)C)O

DOS

IR

Vibrations