Geometry & MOs

Info

ID:	130670
PubChem CID:	51091944
Reduced:	N2O5C18H18 (1)
Stoich.:	A2B5C18D18 (1)
Weight, g/mol:	319.153206
ΔH_f, kcal/mol:	-148.72
Dipole, Da:	5.54
IP(EA), eV:	-8.43(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-1-[2-(2-nitrophenoxy)ethyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)N(C)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations