Geometry & MOs

Info

ID:	249657
PubChem CID:	103091178
Reduced:	ClOC11H13 (1)
Stoich.:	ABC11D13 (1)
Weight, g/mol:	204.151415
ΔH_f, kcal/mol:	-38.64
Dipole, Da:	2.9
IP(EA), eV:	-9.32(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-methyl-4-(4-propan-2-ylphenyl)but-3-en-2-ol

Drug info:

PubChemData

Smile

CC(/C(=C/C1=CC=C(C=C1)Cl)/C)O

DOS

IR

Vibrations