Geometry & MOs

Info

ID:	399230
PubChem CID:	135038936
Reduced:	O2C14H25 (1)
Stoich.:	A2B14C25 (1)
Weight, g/mol:	264.157288
ΔH_f, kcal/mol:	-100.41
Dipole, Da:	3.32
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.755550
Charge, e:	0

Chem-info

IUPAC name:

(Z)-1,4-bis(1,1-dimethoxyethoxy)but-2-ene

Drug info:

PubChemData

Smile

CC(C)(C)[C]1CCCC(C1)(CC=COC)O

DOS

IR

Vibrations