Geometry & MOs

Info

ID:	389598
PubChem CID:	134993960
Reduced:	NaO2C7H11 (1)
Stoich.:	AB2C7D11 (1)
Weight, g/mol:	180.089878
ΔH_f, kcal/mol:	-107.75
Dipole, Da:	6.78
IP(EA), eV:	-7.24(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (Z)-4-imidazol-1-ylbut-2-enoate

Drug info:

PubChemData

Smile

COC(=O)C1CC[CH-]C1.[Na+]

DOS

IR

Vibrations