Geometry & MOs

Info

ID:	26959
PubChem CID:	806059
Reduced:	FNO2H12C20 (1)
Stoich.:	ABC2D12E20 (1)
Weight, g/mol:	300.102941
ΔH_f, kcal/mol:	-14.07
Dipole, Da:	2.43
IP(EA), eV:	-9.04(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(4-pyrrolidin-1-ylphenyl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2/C=C\3/C(=O)OC(=N3)C4=CC=C(C=C4)F

DOS

IR

Vibrations