Geometry & MOs

Info

ID:	385529
PubChem CID:	134979325
Reduced:	OC6H7 (2)
Stoich.:	AB6C7 (2)
Weight, g/mol:	128.08373
ΔH_f, kcal/mol:	-7.52
Dipole, Da:	2.26
IP(EA), eV:	-8.92(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E,3E)-1,4-dimethoxy-2-methylbuta-1,3-diene

Drug info:

PubChemData

Smile

CC(=O)O[C@H]\1/C=C\C/C=C/C=C\C=C1

DOS

IR

Vibrations