Geometry & MOs

Info

ID:	399498
PubChem CID:	135040601
Reduced:	O3C13H14 (1)
Stoich.:	A3B13C14 (1)
Weight, g/mol:	272.17763
ΔH_f, kcal/mol:	-95.14
Dipole, Da:	6.22
IP(EA), eV:	-9.88(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclohexylidenemethyl)-2-methoxy-1-(2-methylprop-2-enoxy)benzene

Drug info:

PubChemData

Smile

CC1=CC(OC1=O)(C)C(C2=CC=CC=C2)O

DOS

IR

Vibrations