Geometry & MOs

Info

ID:	131336
PubChem CID:	51191648
Reduced:	SF2N2O2H14C15 (1)
Stoich.:	AB2C2D2E14F15 (1)
Weight, g/mol:	326.126657
ΔH_f, kcal/mol:	-129.57
Dipole, Da:	5.19
IP(EA), eV:	-9.32(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetylphenyl)-1-(furan-2-carbonyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)NC(=O)CCCNC(=O)C2=CSC=C2)F

DOS

IR

Vibrations