Geometry & MOs

Info

ID:	164419
PubChem CID:	74397917
Reduced:	NO6C15H29 (1)
Stoich.:	AB6C15D29 (1)
Weight, g/mol:	432.146741
ΔH_f, kcal/mol:	-344.67
Dipole, Da:	3.92
IP(EA), eV:	-9.83(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2-nitrophenyl)sulfonylamino]-1-phenylpropyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C(C(CC(=O)OC(C)(C)C)O)NC(=O)OC(C)(C)C)O

DOS

IR

Vibrations