Geometry & MOs

Info

ID:	252640
PubChem CID:	103112885
Reduced:	N3O3C11H19 (1)
Stoich.:	A3B3C11D19 (1)
Weight, g/mol:	299.130363
ΔH_f, kcal/mol:	-96.55
Dipole, Da:	3.2
IP(EA), eV:	-10.21(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-ethyl-1-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]imidazol-2-yl]sulfanylacetic acid

Drug info:

PubChemData

Smile

CC1=C(N=NN1CCOC)C(=O)OCC(C)C

DOS

IR

Vibrations