Geometry & MOs

Info

ID:	439547
PubChem CID:	135229323
Reduced:	O2C19H28 (1)
Stoich.:	A2B19C28 (1)
Weight, g/mol:	154.09938
ΔH_f, kcal/mol:	-102.7
Dipole, Da:	1.63
IP(EA), eV:	-8.89(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethoxy-1-methylcyclohexa-1,3-diene

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)CO[C@H]2C[C@]3(CC[C@@]2(O3)C)C(C)C

DOS

IR

Vibrations