Geometry & MOs

Info

ID:	185809
PubChem CID:	77350894
Reduced:	NSO6C20H25 (1)
Stoich.:	ABC6D20E25 (1)
Weight, g/mol:	434.220557
ΔH_f, kcal/mol:	-228.56
Dipole, Da:	7.8
IP(EA), eV:	-9.88(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(2-methyl-5-phenylpyrrolidin-1-yl) but-2-enedioate

Drug info:

PubChemData

Smile

CC(C1C2CC(=CS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C(N2C1=O)C(=O)O)O

DOS

IR

Vibrations