Geometry & MOs

Info

ID:	190958
PubChem CID:	78086357
Reduced:	N2O4C21H30 (1)
Stoich.:	A2B4C21D30 (1)
Weight, g/mol:	323.163377
ΔH_f, kcal/mol:	-168.92
Dipole, Da:	1.14
IP(EA), eV:	-8.99(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(3-cyanophenyl)methyl]-4-(5-methylfuran-2-yl)pyrrolidin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1CCCC(N1CC(=O)N2CC(C(C2)C(=O)O)C3=CC=CC=C3OC)C

DOS

IR

Vibrations