Geometry & MOs

Info

ID:	130567
PubChem CID:	51091299
Reduced:	N3O4C16H21 (1)
Stoich.:	A3B4C16D21 (1)
Weight, g/mol:	319.153206
ΔH_f, kcal/mol:	-151.19
Dipole, Da:	3.78
IP(EA), eV:	-8.62(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[2-oxo-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]ethyl]amino]benzoate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC=C1NCC(=O)NCC(=O)N2CCCC2

DOS

IR

Vibrations