Geometry & MOs

Info

ID:	28694
PubChem CID:	829012
Reduced:	O2S2N3C16H17 (1)
Stoich.:	A2B2C3D16E17 (1)
Weight, g/mol:	252.102941
ΔH_f, kcal/mol:	-11.79
Dipole, Da:	5.9
IP(EA), eV:	-9.37(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chlorophenyl)-3-pyrrolidin-1-ylpropanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC=CS2)C#N)C

DOS

IR

Vibrations