Geometry & MOs

Info

ID:	130218
PubChem CID:	51075297
Reduced:	O2N4C13H22 (1)
Stoich.:	A2B4C13D22 (1)
Weight, g/mol:	314.160598
ΔH_f, kcal/mol:	-27.43
Dipole, Da:	1.51
IP(EA), eV:	-8.54(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-pyrrolidin-1-ylpropyl)-2-[4-(trifluoromethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C(=O)NCCCN2CCN(CC2)C

DOS

IR

Vibrations