Geometry & MOs

Info

ID:	249635
PubChem CID:	103091045
Reduced:	ON3C13H15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	220.14633
ΔH_f, kcal/mol:	38.8
Dipole, Da:	3.03
IP(EA), eV:	-8.85(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-methyl-4-(4-propoxyphenyl)but-3-en-2-ol

Drug info:

PubChemData

Smile

CC(/C(=C/C1=NN(N=C1)C2=CC=CC=C2)/C)O

DOS

IR

Vibrations