Geometry & MOs

Info

ID:	350069
PubChem CID:	127276942
Reduced:	O2N5C17H25 (1)
Stoich.:	A2B5C17D25 (1)
Weight, g/mol:	393.208613
ΔH_f, kcal/mol:	-31.87
Dipole, Da:	9.68
IP(EA), eV:	-8.93(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethylpyrrolidin-1-yl)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CCC1CCCN1CC(=O)N2CCN(CC2)C3=C(N=C(O3)C)C#N

DOS

IR

Vibrations