Geometry & MOs

Info

ID:	209756
PubChem CID:	80715092
Reduced:	SO3N4C10H16 (1)
Stoich.:	AB3C4D10E16 (1)
Weight, g/mol:	253.142641
ΔH_f, kcal/mol:	-89.2
Dipole, Da:	7.24
IP(EA), eV:	-9.74(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-amino-2-ethyl-1-(oxolan-3-yl)imidazole-4-carboxylate

Drug info:

PubChemData

Smile

CCNC1=NC=C(C=N1)S(=O)(=O)NC2CCOC2

DOS

IR

Vibrations