Geometry & MOs

Info

ID:	337768
PubChem CID:	127258391
Reduced:	N3O5C7H11 (1)
Stoich.:	A3B5C7D11 (1)
Weight, g/mol:	212.079707
ΔH_f, kcal/mol:	-171.01
Dipole, Da:	5.25
IP(EA), eV:	-10.01(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-ethyl 4-O-imidazol-1-yl butanedioate

Drug info:

PubChemData

Smile

CNC(=O)/C(=N/OC(=O)CCC(=O)O)/N

DOS

IR

Vibrations