Geometry & MOs

Info

ID:	45731
PubChem CID:	10517153
Reduced:	O3C7H10 (2)
Stoich.:	A3B7C10 (2)
Weight, g/mol:	284.116092
ΔH_f, kcal/mol:	-252.52
Dipole, Da:	5.26
IP(EA), eV:	-9.76(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2Z)-2-(6-oxo-7-phenyl-2,3-dihydro-1H-pyrrolo[1,2-a]imidazol-5-ylidene)acetate

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O

DOS

IR

Vibrations