Geometry & MOs

Info

ID:	26300
PubChem CID:	643864
Reduced:	ClN2O2C6H7 (1)
Stoich.:	AB2C2D6E7 (1)
Weight, g/mol:	194.094294
ΔH_f, kcal/mol:	-62.44
Dipole, Da:	5.22
IP(EA), eV:	-9.94(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dimethoxy-4-[(Z)-prop-1-enoxy]benzene

Drug info:

PubChemData

Smile

CCOC(=O)/C(=C(\N)/Cl)/C#N

DOS

IR

Vibrations