Geometry & MOs

Info

ID:	290231
PubChem CID:	104421123
Reduced:	O2N3C13H25 (1)
Stoich.:	A2B3C13D25 (1)
Weight, g/mol:	241.179027
ΔH_f, kcal/mol:	-124.76
Dipole, Da:	2.33
IP(EA), eV:	-8.54(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-N-[3-(ethylamino)-3-oxopropyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCNC(=O)CCNC(=O)CCC1CCCCN1

DOS

IR

Vibrations