Geometry & MOs

Info

ID:	55793
PubChem CID:	17396546
Reduced:	ClNO4C12H14 (1)
Stoich.:	ABC4D12E14 (1)
Weight, g/mol:	370.152872
ΔH_f, kcal/mol:	-165.52
Dipole, Da:	1.16
IP(EA), eV:	-9.63(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-O-[2-(cyclopropylamino)-2-oxo-1-phenylethyl] 4-O-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Drug info:

PubChemData

Smile

CC1=C(NC(=C1C(=O)OC)C)C(=O)OCC(=C)Cl

DOS

IR

Vibrations