Geometry & MOs

Info

ID:	341086
PubChem CID:	127263521
Reduced:	ClN3C15H20 (1)
Stoich.:	AB3C15D20 (1)
Weight, g/mol:	223.132077
ΔH_f, kcal/mol:	22.14
Dipole, Da:	2.24
IP(EA), eV:	-8.68(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-7-yl N-tert-butylcarbamate

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2=CC=C(C=C2)C3CCNCC3.Cl

DOS

IR

Vibrations