Geometry & MOs

Info

ID:	366031
PubChem CID:	127319337
Reduced:	ClO2N3C17H22 (1)
Stoich.:	AB2C3D17E22 (1)
Weight, g/mol:	239.163377
ΔH_f, kcal/mol:	-83.42
Dipole, Da:	4.76
IP(EA), eV:	-8.82(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(1-methylpyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN1CCCC1C(=O)NC2=C(C=C(C=C2)Cl)C(=O)N3CCCC3

DOS

IR

Vibrations